Exact Mass: 442.1001944

Exact Mass Matches: 442.1001944

Found 339 metabolites which its exact mass value is equals to given mass value 442.1001944, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

12-Dehydrotetracycline

5a,11a-Dehydrotetracycline; 12-Dehydrotetracycline

C22H22N2O8 (442.1376092)


The 12-dehydro derivative of tetracycline.

   

Methacycline

(4S,4aR,5S,5aR,12aS)-4-(dimethylamino)-5,10,12,12a-tetrahydroxy-6-methylidene-1,3,11-trioxo-1,2,3,4,4a,5,5a,6,11,12a-decahydrotetracene-2-carboxamide

C22H22N2O8 (442.1376092)


Methacycline is only found in individuals that have used or taken this drug. It is a broad-spectrum semisynthetic antibiotic related to tetracycline but excreted more slowly and maintaining effective blood levels for a more extended period. [PubChem]Methacycline, a tetracycline antibiotic, is a protein synthesis inhibitors, inhibiting the binding of aminoacyl-tRNA to the mRNA-ribosome complex. Methacycline inhibits cell growth by inhibiting translation. It binds to the 16S part of the 30S ribosomal subunit and prevents the amino-acyl tRNA from binding to the A site of the ribosome. The binding is reversible in nature. Tetracyclines also have been found to inhibit matrix metalloproteinases. This mechanism does not add to their antibiotic effects, but has led to extensive research on chemically modified tetracyclines or CMTs (like incyclinide) for the treatmet of rosacea, acne, and various types of neoplasms. J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01A - Tetracyclines > J01AA - Tetracyclines C784 - Protein Synthesis Inhibitor > C1595 - Tetracycline Antibiotic D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents C254 - Anti-Infective Agent > C258 - Antibiotic

   

(-)-Epicatechin 3-O-gallate

Benzoic acid, 3,4,5-trihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-cis)-

C22H18O10 (442.0899928)


(-)-epicatechin-3-O-gallate is a gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of epicatechin. A natural product found in Parapiptadenia rigida. It has a role as a metabolite, an EC 3.2.1.1 (alpha-amylase) inhibitor and an EC 3.2.1.20 (alpha-glucosidase) inhibitor. It is a catechin, a gallate ester and a polyphenol. It is functionally related to a (-)-epicatechin and a gallic acid. (-)-Epicatechin gallate is a natural product found in Scurrula atropurpurea, Acacia omalophylla, and other organisms with data available. Isolated from tea and numerous other plant subspecies inc. rhubarb and grapes. Epicatechin 3-gallate is found in many foods, some of which are cucumber, muskmelon, black raspberry, and cashew nut. A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of epicatechin. A natural product found in Parapiptadenia rigida. (-)-Epicatechin 3-O-gallate is found in almond. (-)-Epicatechin 3-O-gallate is isolated from tea and numerous other plant species including rhubarb and grapes. D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

(-)-Catechin 3-O-gallate

Benzoic acid, 3,4,5-trihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2S-trans)-

C22H18O10 (442.0899928)


(-)-catechin-3-O-gallate is a gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of (-)-catechin. It has a role as a metabolite. It is a gallate ester, a polyphenol and a member of flavans. It is functionally related to a (-)-catechin and a gallic acid. It is an enantiomer of a (+)-catechin-3-O-gallate. (-)-Catechin gallate is a natural product found in Rheum palmatum, Vitis vinifera, and other organisms with data available. A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of (-)-catechin. (-)-Catechin 3-O-gallate is a polyphenol compound found in foods of plant origin (PMID: 20428313) (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes.

   

7-Galloylcatechin

2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-1-benzopyran-7-yl 3,4,5-trihydroxybenzoic acid

C22H18O10 (442.0899928)


7-Galloylcatechin is found in herbs and spices. 7-Galloylcatechin is isolated from roots of great burnet (Sanguisorba officinalis). Isolated from roots of great burnet (Sanguisorba officinalis). Catechin 7-gallate is found in tea and herbs and spices.

   

1-O-E-Cinnamoyl-(6-arabinosylglucose)

6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl (2E)-3-phenylprop-2-enoic acid

C20H26O11 (442.14750460000005)


1-O-E-Cinnamoyl-(6-arabinosylglucose) is found in fruits. 1-O-E-Cinnamoyl-(6-arabinosylglucose) is a constituent of Psidium guajava (guava)

   

[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-5-yl] 3,4,5-trihydroxybenzoate

[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-5-yl] 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   

3-Galloylcatechin

2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoic acid

C22H18O10 (442.0899928)


Constituent of Bergenia crassifolia (Siberian tea). Catechin 3-gallate is found in many foods, some of which are macadamia nut (m. tetraphylla), tea, avocado, and pecan nut. 3-Galloylcatechin is found in almond. 3-Galloylcatechin is a constituent of Bergenia crassifolia (Siberian tea) (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

Epicatechin-3-gallate

(2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   

Biflavone

2,2-diphenyl-4H,4H-[3,3-bichromene]-4,4-dione

C30H18O4 (442.1205028)


   

Indanthrene

2,17-diazaheptacyclo[16.12.0.0³,¹⁶.0⁴,¹³.0⁶,¹¹.0¹⁹,²⁸.0²¹,²⁶]triaconta-1(18),3(16),4(13),6,8,10,14,19(28),21,23,25,29-dodecaene-5,12,20,27-tetrone

C28H14N2O4 (442.0953524)


   

Rondomycin

4-(Dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methylidene-3,12-dioxo-3,4,4a,5,5a,6,12,12a-octahydrotetracene-2-carboximidate

C22H22N2O8 (442.1376092)


   
   

Piflufolastat F 18 

(2S)-2-({[(1S)-1-carboxy-5-{[6-(¹⁸F)fluoropyridin-3-yl]formamido}pentyl]carbamoyl}amino)pentanedioic acid

C18H23FN4O8 (442.14998499999996)


   

Villol

(2R) -1,2,12,12aalpha-Tetrahydro-5,6aalpha,12alpha-trihydroxy-8,9-dimethoxy-2alpha- (1-methylvinyl) [ 1 ] benzopyrano [ 3,4-b ] furo [ 2,3-h ] [ 1 ] benzopyran-6 (6aH) -one

C23H22O9 (442.1263762)


   
   
   
   
   
   
   
   
   
   
   

Pratensin A

(E)-5,7-Dihydroxy-3,6-dimethoxy-2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-8-yl ester 2-methyl-2-butenoic acid

C23H22O9 (442.1263762)


   

ent-Epicatechin 3-O-gallate

(2S,3S) -3,5,7,3,4-Pentahydroxyflavan 3-O-gallate

C22H18O10 (442.0899928)


   

Epicatechin-3-gallate

(2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

Robinetinidol 3-O-gallate

(2R,3S) -3,7,3,4,5-Pentahydroxyflavan 3-O-gallate

C22H18O10 (442.0899928)


   

ent-Robinetinidol 3-O-gallate

ent-Robinetinidol 3-O-gallate

C22H18O10 (442.0899928)


   

(-)-Catechin gallate

3,4,5-Trihydroxybenzoic acid [ [ (2S) -2beta- (3,4-dihydroxyphenyl) -3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran ] -3alpha-yl ] ester

C22H18O10 (442.0899928)


(-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes.

   

Catechin 4-O-gallate

(2R,3S) -3,5,7,3,4-Pentahydroxyflavan 4-O-gallate

C22H18O10 (442.0899928)


   

Flaccidine

3,5,7-Trihydroxy-8,3,4-trimethoxyflavone 3-angelate

C23H22O9 (442.1263762)


   

Catechin 7-O-gallate

(2R,3S) -3,5,7,3,4-Pentahydroxyflavan 7-O-gallate

C22H18O10 (442.0899928)


   
   
   
   

Regaloside B

[(2S)-3-acetyloxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] (E)-3-(4-hydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


Regaloside B is a natural product found in Lilium auratum and Lilium brownii with data available. Regaloside B is a phenylpropanoid isolated from Lilium longiflorum. Regaloside B can inhibit the expression of iNOS and COX-2. Regaloside B has anti-inflammatory activity[1][2]. Regaloside B is a phenylpropanoid isolated from Lilium longiflorum. Regaloside B can inhibit the expression of iNOS and COX-2. Regaloside B has anti-inflammatory activity[1][2].

   

N-L-gamma-glutamyl-S-sinapyl-L-cysteine

N-L-gamma-glutamyl-S-sinapyl-L-cysteine

C19H26N2O8S (442.14097960000004)


   

Litmomycin (Cyanaticin A)

Litmomycin (Cyanaticin A)

C23H22O9 (442.1263762)


   

(+)-Catechin 4-O-gallate|4-O-(3,4,5-Trihydroxybenzoyl)-(2R,3S)-3,3,4,5,7-Pentahydroxyflavan

(+)-Catechin 4-O-gallate|4-O-(3,4,5-Trihydroxybenzoyl)-(2R,3S)-3,3,4,5,7-Pentahydroxyflavan

C22H18O10 (442.0899928)


   
   

8a-[4-(alpha-rhamnopyranosyl)-2-oxo-2,5-dihydro-furan-3-ylmethyl]-6-methyl-tetrahydro-furo[3,4-c]oxepine-1,8-dione

8a-[4-(alpha-rhamnopyranosyl)-2-oxo-2,5-dihydro-furan-3-ylmethyl]-6-methyl-tetrahydro-furo[3,4-c]oxepine-1,8-dione

C20H26O11 (442.14750460000005)


   
   
   

2,5-bis(2-hydroxyethylthio)-(-)-epicatecin

2,5-bis(2-hydroxyethylthio)-(-)-epicatecin

C19H22O8S2 (442.0756052)


   

NH2-alanyl-glycyl-glutamyl-phocphoserine-COOH

NH2-alanyl-glycyl-glutamyl-phocphoserine-COOH

C13H23N4O11P (442.1100898)


   

2,2-diamino-4,4-dioxo-4,4-(2-amino-3-oxo-3H-phenoxazine-1,9-diyl)-bis-butyric acid

2,2-diamino-4,4-dioxo-4,4-(2-amino-3-oxo-3H-phenoxazine-1,9-diyl)-bis-butyric acid

C20H18N4O8 (442.11245879999996)


   

(+)-phrymarin II|1-acetoxy-2e-piperonyl-6e-[6-methoxypiperonyl]-3,7-dioxabicyclo[3.3.0]octane

(+)-phrymarin II|1-acetoxy-2e-piperonyl-6e-[6-methoxypiperonyl]-3,7-dioxabicyclo[3.3.0]octane

C23H22O9 (442.1263762)


   
   

(-)-sanguinolignan C|(8S,7S,8R)-7-acetoxy-3,4-methylenedioxy-3,4-dimethoxy-7-oxolignano-9,9-lactone

(-)-sanguinolignan C|(8S,7S,8R)-7-acetoxy-3,4-methylenedioxy-3,4-dimethoxy-7-oxolignano-9,9-lactone

C23H22O9 (442.1263762)


   
   

3-O-galloyl-(-)-epicatechin

3-O-galloyl-(-)-epicatechin

C22H18O10 (442.0899928)


   
   

5,7,8-trihydroxycoumarin-5-beta-(6-O-malonylglucopyranoside)

5,7,8-trihydroxycoumarin-5-beta-(6-O-malonylglucopyranoside)

C18H18O13 (442.0747378)


   

2,3-Dimethoxy-14,15-dihydroxy-16,16-dimethyl-9,10-(epoxypropano)-5,11,13-trioxa-5H-benzo[4,5]cyclohepta[1,2-b]naphthalene-6(12H)-one

2,3-Dimethoxy-14,15-dihydroxy-16,16-dimethyl-9,10-(epoxypropano)-5,11,13-trioxa-5H-benzo[4,5]cyclohepta[1,2-b]naphthalene-6(12H)-one

C23H22O9 (442.1263762)


   

14-isovaleroxyscorzoaustricin sulfate

14-isovaleroxyscorzoaustricin sulfate

C20H26O9S (442.1297466000001)


   

7,8-dihydroxy-6-[3-beta-D-glucopyranosyloxy-2(zeta)-hydroxy-3-methylbutyl]coumarin|skimminan

7,8-dihydroxy-6-[3-beta-D-glucopyranosyloxy-2(zeta)-hydroxy-3-methylbutyl]coumarin|skimminan

C20H26O11 (442.14750460000005)


   

Hydrohydroxyisocalanone

Hydrohydroxyisocalanone

C27H22O6 (442.1416312)


   

Glaberide I 4-O-beta-D-glucopyranoside

Glaberide I 4-O-beta-D-glucopyranoside

C20H26O11 (442.14750460000005)


   

(-)-(1R*,2S*,3S*,4S*,5R*,6R*)-2-O-acetyl-4-O-benzoyl-1-benzoyloxymethyl-1,6-epoxycyclohexan-2,3,4,5-tetrol|2-acetylrotepoxide B

(-)-(1R*,2S*,3S*,4S*,5R*,6R*)-2-O-acetyl-4-O-benzoyl-1-benzoyloxymethyl-1,6-epoxycyclohexan-2,3,4,5-tetrol|2-acetylrotepoxide B

C23H22O9 (442.1263762)


   
   

7-O-Galloyltricetiflavan

7-O-Galloyltricetiflavan

C22H18O10 (442.0899928)


A gallate ester obtained by the formal condensation of gallic acid with the hydroxy group at position 7 of 3,4,5,5,7-pentahydroxyflavan. Isolated from the leaves of Pithecellobium clypearia, it exhibits antiviral activity.

   

4-acetyl-4-demethyl-podophyllotoxin

4-acetyl-4-demethyl-podophyllotoxin

C23H22O9 (442.1263762)


   

iotrochamide B|N-(Z)-2-methoxycinnamoyl-L-6-bromotryptophan

iotrochamide B|N-(Z)-2-methoxycinnamoyl-L-6-bromotryptophan

C21H19BrN2O4 (442.05281140000005)


   

4-((6-O-caffeoyl-beta-D-glucopyranosyl)oxy)-2-methylbutyric acid

4-((6-O-caffeoyl-beta-D-glucopyranosyl)oxy)-2-methylbutyric acid

C20H26O11 (442.14750460000005)


   
   
   

2-acetyl-3-[(E)-caffeoyl]-1-[(E)-p-coumaroyl]glycerol|Lasiocarpin B

2-acetyl-3-[(E)-caffeoyl]-1-[(E)-p-coumaroyl]glycerol|Lasiocarpin B

C23H22O9 (442.1263762)


   

Mulberrofuran H

5-(6-hydroxy-1-benzofuran-2-yl)-2-[(1S,9S)-5-hydroxy-9-methyl-8-oxatricyclo[7.3.1.02,7]trideca-2(7),3,5,10-tetraen-11-yl]benzene-1,3-diol

C27H22O6 (442.1416312)


Mulberrofuran H is a natural product found in Morus lhou, Morus mongolica, and Morus alba with data available.

   

13beta,21-Dihydroxyeurycomanone|pasakbumin-D

13beta,21-Dihydroxyeurycomanone|pasakbumin-D

C20H26O11 (442.14750460000005)


   

versiconal acetate

versiconal acetate

C23H22O9 (442.1263762)


   
   

5-O-trans-cinnamoyl beta-D-apiosyl(1->3)-alpha-D-glucopyranoside|visartiside D

5-O-trans-cinnamoyl beta-D-apiosyl(1->3)-alpha-D-glucopyranoside|visartiside D

C20H26O11 (442.14750460000005)


   

5,7-dihydroxytephrosin

5,7-dihydroxytephrosin

C23H22O9 (442.1263762)


   
   

2-amino-5-[[1-(carboxymethylamino)-3-[(4-nitrophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

2-amino-5-[[1-(carboxymethylamino)-3-[(4-nitrophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

C17H22N4O8S (442.1158292)


   

RubioncolinC

methyl 4-(1,4-dioxonaphthalen-2-yl)oxy-1-hydroxy-3-(3-methylbut-2-enyl)naphthalene-2-carboxylate

C27H22O6 (442.1416312)


Rubioncolin C is a natural product found in Rubia oncotricha with data available.

   

Rubipodanone A

Rubipodanone A

C27H22O6 (442.1416312)


Rubipodanone A, a naphthohydroquinone dimer, shows cytotoxicity against A549, BEL-7402, HeLa, HepG2, SGC-7901 and U251 cells. Rubipodanone A also shows obvious activating effect at 20 and 40 μM for NF-κB[1].

   

Yadanziolide B

(1R,2R,3R,6S,7R,8S,12S,13S,14R,15R,16S,17R)-2,3,7,12,15,16-hexahydroxy-17-(hydroxymethyl)-9,13-dimethyl-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-ene-4,11-dione

C20H26O11 (442.14750460000005)


Yadanziolide B is a quassinoid that is 13,20-epoxypicras-3-ene substituted by hydroxy groups at positions 1, 6, 11, 12, 14, 15 and 21 and oxo groups at positions 2 and 16. Isolated from the ethanol extract of the stem of Brucea mollis, it exhibits cytotoxic activity. It has a role as an antineoplastic agent and a plant metabolite. It is a quassinoid, a delta-lactone, an enone, an organic heteropentacyclic compound, a heptol and a secondary alpha-hydroxy ketone. It derives from a hydride of a picrasane. Yadanziolide B is a natural product found in Brucea javanica and Brucea mollis with data available. A quassinoid that is 13,20-epoxypicras-3-ene substituted by hydroxy groups at positions 1, 6, 11, 12, 14, 15 and 21 and oxo groups at positions 2 and 16. Isolated from the ethanol extract of the stem of Brucea mollis, it exhibits cytotoxic activity.

   

Pasakbumin D

Pasakbumin D

C20H26O11 (442.14750460000005)


Pasakbumin D is a natural product found in Eurycoma longifolia with data available.

   
   

catechin gallate

(-)-Catechin gallate

C22H18O10 (442.0899928)


(-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes.

   

[(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate

NCGC00179135-03![(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   

[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate

NCGC00385833-01![(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   
   

NCGC00380987-01

NCGC00380987-01!

C23H22O9 (442.1263762)


   

(-)-Epicatechin gallate

(-)-Epicatechin-3-O-gallate

C22H18O10 (442.0899928)


(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

EPICATECHIN 3-O-GALLATE

EPICATECHIN 3-O-GALLATE

C22H18O10 (442.0899928)


   

epicatechin-3-O-gallate

epicatechin-3-O-gallate

C22H18O10 (442.0899928)


   
   

epicatechin gallate

epicatechin gallate

C22H18O10 (442.0899928)


(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate

[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   

epicatechin monogallate

epicatechin monogallate

C22H18O10 (442.0899928)


(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate [IIN-based on: CCMSLIB00000848607]

NCGC00385833-01![(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate [IIN-based on: CCMSLIB00000848607]

C22H18O10 (442.0899928)


   

[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate [IIN-based: Match]

NCGC00385833-01![(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate [IIN-based: Match]

C22H18O10 (442.0899928)


   

N2-Aristololactam-I-guanine

N2-Aristololactam-I-guanine

C22H14N6O5 (442.1025634)


   

Ala Cys Cys Phe

(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-phenylpropanoic acid

C18H26N4O5S2 (442.1344546)


   

Ala Cys Phe Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]-3-sulfanylpropanoic acid

C18H26N4O5S2 (442.1344546)


   

Ala Phe Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C18H26N4O5S2 (442.1344546)


   

Cys Ala Cys Phe

(2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-3-sulfanylpropanamido]-3-phenylpropanoic acid

C18H26N4O5S2 (442.1344546)


   

Cys Ala Phe Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-3-phenylpropanamido]-3-sulfanylpropanoic acid

C18H26N4O5S2 (442.1344546)


   

Cys Cys Ala Phe

(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]propanamido]-3-phenylpropanoic acid

C18H26N4O5S2 (442.1344546)


   

Cys Cys Cys Asp

(2S)-2-[(2R)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]butanedioic acid

C13H22N4O7S3 (442.0650582)


   

Cys Cys Asp Cys

(3S)-3-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C13H22N4O7S3 (442.0650582)


   

Cys Cys Phe Ala

(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]propanoic acid

C18H26N4O5S2 (442.1344546)


   

Cys Cys Met Ser

(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-3-hydroxypropanoic acid

C14H26N4O6S3 (442.1014416)


   

Cys Cys Ser Met

(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-hydroxypropanamido]-4-(methylsulfanyl)butanoic acid

C14H26N4O6S3 (442.1014416)


   

Cys Asp Cys Cys

(3S)-3-[(2R)-2-amino-3-sulfanylpropanamido]-3-{[(1R)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propanoic acid

C13H22N4O7S3 (442.0650582)


   

Cys Phe Ala Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]propanamido]-3-sulfanylpropanoic acid

C18H26N4O5S2 (442.1344546)


   

Cys Phe Cys Ala

(2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]propanoic acid

C18H26N4O5S2 (442.1344546)


   

Cys Met Cys Ser

(2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-3-hydroxypropanoic acid

C14H26N4O6S3 (442.1014416)


   

Cys Met Ser Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-3-hydroxypropanamido]-3-sulfanylpropanoic acid

C14H26N4O6S3 (442.1014416)


   

Cys Ser Cys Met

(2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanoic acid

C14H26N4O6S3 (442.1014416)


   

Cys Ser Met Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanoic acid

C14H26N4O6S3 (442.1014416)


   

Asp Cys Cys Cys

(3S)-3-amino-3-{[(1R)-1-{[(1R)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propanoic acid

C13H22N4O7S3 (442.0650582)


   

Asp Asp Gly His

(3S)-3-[(2S)-2-amino-3-carboxypropanamido]-3-[({[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}methyl)carbamoyl]propanoic acid

C16H22N6O9 (442.1448202)


   

Asp Asp His Gly

(3S)-3-[(2S)-2-amino-3-carboxypropanamido]-3-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C16H22N6O9 (442.1448202)


   

Asp Gly Asp His

(3S)-3-{2-[(2S)-2-amino-3-carboxypropanamido]acetamido}-3-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C16H22N6O9 (442.1448202)


   

Asp Gly His Asp

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-carboxypropanamido]acetamido}-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C16H22N6O9 (442.1448202)


   

Asp His Asp Gly

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-[(carboxymethyl)carbamoyl]propanoic acid

C16H22N6O9 (442.1448202)


   

Asp His Gly Asp

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]acetamido}butanedioic acid

C16H22N6O9 (442.1448202)


   

Mometasone Metabolite (Pregna-1,4-diene-3,20-dione, 9,21-dichloro-6,11,17-trihydroxy-16-methyl-, (6b

Mometasone Metabolite (Pregna-1,4-diene-3,20-dione, 9,21-dichloro-6,11,17-trihydroxy-16-methyl-, (6b

C22H28Cl2O5 (442.1313698)


   

Mometasone Metabolite (Pregna-1,4-diene-3,20-dione, 9,21-dichloro-6,11,17-trihydroxy-16-methyl-, (6a

Mometasone Metabolite (Pregna-1,4-diene-3,20-dione, 9,21-dichloro-6,11,17-trihydroxy-16-methyl-, (6a

C22H28Cl2O5 (442.1313698)


   

Phe Ala Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]propanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C18H26N4O5S2 (442.1344546)


   

Phe Cys Ala Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]propanamido]-3-sulfanylpropanoic acid

C18H26N4O5S2 (442.1344546)


   

Phe Cys Cys Ala

(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]propanoic acid

C18H26N4O5S2 (442.1344546)


   

Gly Asp Asp His

(3S)-3-[(2S)-2-(2-aminoacetamido)-3-carboxypropanamido]-3-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C16H22N6O9 (442.1448202)


   

Gly Asp His Asp

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C16H22N6O9 (442.1448202)


   

Gly His Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]butanedioic acid

C16H22N6O9 (442.1448202)


   

His Asp Asp Gly

(3S)-3-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]-3-[(carboxymethyl)carbamoyl]propanoic acid

C16H22N6O9 (442.1448202)


   

His Asp Gly Asp

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]acetamido}butanedioic acid

C16H22N6O9 (442.1448202)


   

His Gly Asp Asp

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-carboxypropanamido]butanedioic acid

C16H22N6O9 (442.1448202)


   

Met Cys Cys Ser

(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-hydroxypropanoic acid

C14H26N4O6S3 (442.1014416)


   

Met Cys Ser Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-sulfanylpropanoic acid

C14H26N4O6S3 (442.1014416)


   

Met Ser Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C14H26N4O6S3 (442.1014416)


   
   

Ser Cys Cys Met

(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanoic acid

C14H26N4O6S3 (442.1014416)


   

Ser Cys Met Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanoic acid

C14H26N4O6S3 (442.1014416)


   

Ser Met Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C14H26N4O6S3 (442.1014416)


   

S-(4-Nitrobenzyl)glutathione

Glycine, L-g-glutamyl-S-[(4-nitrophenyl)methyl]-L-cysteinyl-

C17H22N4O8S (442.1158292)


   

methacycline

methacycline

C22H22N2O8 (442.1376092)


J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01A - Tetracyclines > J01AA - Tetracyclines A tetracycline that is the 6-methylene analogue of oxytetracycline, obtained by formal dehydration at position 6. C784 - Protein Synthesis Inhibitor > C1595 - Tetracycline Antibiotic D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents C254 - Anti-Infective Agent > C258 - Antibiotic

   

Catechin 3-O-gallate

Catechin 3-O-gallate

C22H18O10 (442.0899928)


   

(-)-Epicatechin 3-O-gallate

(-)-Epicatechin 3-O-gallate

C22H18O10 (442.0899928)


   

Catechin 5-O-gallate

Catechin 5-O-gallate

C22H18O10 (442.0899928)


   

1-O-E-Cinnamoyl-(6-arabinosylglucose)

6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl (2E)-3-phenylprop-2-enoate

C20H26O11 (442.14750460000005)


   

Icosyl palmitate

2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-1-benzopyran-7-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   
   

(R)-(-)-1,1-BI-2-NAPHTHYL DIMETHANESUL&

(R)-(-)-1,1-BI-2-NAPHTHYL DIMETHANESUL&

C22H18O6S2 (442.0544768)


   

2-(1,3-Dioxolan-2-yl)ethyltriphenylphosphonium bromide

2-(1,3-Dioxolan-2-yl)ethyltriphenylphosphonium bromide

C23H24BrO2P (442.0697194)


   

1 1-BI-2-NAPHTHYL DIMETHANESULFONATE&

1 1-BI-2-NAPHTHYL DIMETHANESULFONATE&

C22H18O6S2 (442.0544768)


   

7-Amino-8-oxo-3-(cis-prop-1-enyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid diphenylmethyl ester hydrochloride

7-Amino-8-oxo-3-(cis-prop-1-enyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid diphenylmethyl ester hydrochloride

C23H23ClN2O3S (442.1117838)


   

(4-methoxyphenyl)-diphenylsulfanium,trifluoromethanesulfonate

(4-methoxyphenyl)-diphenylsulfanium,trifluoromethanesulfonate

C20H17F3O4S2 (442.0520318)


   

(1S,2S)-1,2-Bis(4-dimethylaminophenyl)-1,2-ethanediamine tetrahydrochloride

(1S,2S)-1,2-Bis(4-dimethylaminophenyl)-1,2-ethanediamine tetrahydrochloride

C18H30Cl4N4 (442.12244599999997)


   

2-benzofuran-1,3-dione,ethane-1,2-diol,furan-2,5-dione,3-(3-hydroxypropoxy)propan-1-ol

2-benzofuran-1,3-dione,ethane-1,2-diol,furan-2,5-dione,3-(3-hydroxypropoxy)propan-1-ol

C20H26O11 (442.14750460000005)


   

6-bromo-2-[4-(diethylamino)phenyl]-1-ethylbenz[cd]indolium chloride

6-bromo-2-[4-(diethylamino)phenyl]-1-ethylbenz[cd]indolium chloride

C23H24BrClN2 (442.0811274)


   

2,2-dimethylpropane-1,3-diol,1,3-dioxo-2-benzofuran-5-carboxylic acid,hexanedioic acid

2,2-dimethylpropane-1,3-diol,1,3-dioxo-2-benzofuran-5-carboxylic acid,hexanedioic acid

C20H26O11 (442.14750460000005)


   

(4-Carboxybutyl)triphenylphosphonium bromide

(4-Carboxybutyl)triphenylphosphonium bromide

C23H24BrO2P (442.0697194)


   

(1-ethoxy-1-oxopropan-2-yl)-triphenylphosphanium,bromide

(1-ethoxy-1-oxopropan-2-yl)-triphenylphosphanium,bromide

C23H24BrO2P (442.0697194)


   

Sepantronium bromide

YM155 (Sepantronium Bromide)

C20H19BrN4O3 (442.06404440000006)


C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor

   

Zuclopenthixol acetate

Zuclopenthixol acetate

C24H27ClN2O2S (442.14816720000005)


D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent

   

Telenzepine dihydrochloride

Telenzepine dihydrochloride

C19H24Cl2N4O2S (442.0996944)


Telenzepine dihydrochloride is a selective and orally active muscarinic M1 receptor antagonist with a Ki of 0.94 nM. Telenzepine dihydrochloride inhibits gastric acid secretion and has antiulcer effects[1][2][3].

   

4-(4,6-dicyano-2-ethoxynaphthalen-1-yl)-3-ethoxynaphthalene-1,7-dicarbonitrile

4-(4,6-dicyano-2-ethoxynaphthalen-1-yl)-3-ethoxynaphthalene-1,7-dicarbonitrile

C28H18N4O2 (442.14296879999995)


   

lithium 1-amino-9,10-dihydro-9,10-dioxo-4-[(2,4,6-trimethylphenyl)amino]anthracene-2-sulphonate

lithium 1-amino-9,10-dihydro-9,10-dioxo-4-[(2,4,6-trimethylphenyl)amino]anthracene-2-sulphonate

C23H19LiN2O5S (442.11746740000007)


   

alpha-apo-oxytetracycline

alpha-apo-oxytetracycline

C22H22N2O8 (442.1376092)


   

MK-0752

MK-0752

C21H21ClF2O4S (442.0817080000001)


D004791 - Enzyme Inhibitors > D000091062 - Gamma Secretase Inhibitors and Modulators C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor

   

Methyl 2-oxo-3-{[2-(5-oxo-2,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-2,3-dihydro-1H-benzimidazole-4-carboxylate

Methyl 2-oxo-3-{[2-(5-oxo-2,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-2,3-dihydro-1H-benzimidazole-4-carboxylate

C24H18N4O5 (442.1277138)


   

N-[(11bS)-4,5-Dihydro-3H-dinaphtho[2,1-c:1,2-e]azepin-2-yl]trifluoromethanesulfonamide

N-[(11bS)-4,5-Dihydro-3H-dinaphtho[2,1-c:1,2-e]azepin-2-yl]trifluoromethanesulfonamide

C23H17F3N2O2S (442.0962778)


   

(3aR,4R,5R,6aS)- 5-(benzoyloxy)-4-[(1E,3S)-4-(3-chlorophenoxy)-3-hydroxy-1-buten-1-yl]hexahydro-2H-Cyclopenta[b]furan-2-one

(3aR,4R,5R,6aS)- 5-(benzoyloxy)-4-[(1E,3S)-4-(3-chlorophenoxy)-3-hydroxy-1-buten-1-yl]hexahydro-2H-Cyclopenta[b]furan-2-one

C24H23ClO6 (442.1183088)


   

α-Apo-oxytetracycline

α-Apo-oxytetracycline

C22H22N2O8 (442.1376092)


   

1,3-Dimethoxy-1,1,3,3-tetraphenyldisiloxane

1,3-Dimethoxy-1,1,3,3-tetraphenyldisiloxane

C26H26O3Si2 (442.1420406)


   

[2-(1-methylsulfonyloxynaphthalen-2-yl)naphthalen-1-yl] methanesulfonate

[2-(1-methylsulfonyloxynaphthalen-2-yl)naphthalen-1-yl] methanesulfonate

C22H18O6S2 (442.0544768)


   

(5R,6S)-4-NITROBENZYL 3-((2-AMINOETHYL)THIO)-6-((R)-1-HYDROXYETHYL)-7-OXO-1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLATE HYDROCHLORIDE

(5R,6S)-4-NITROBENZYL 3-((2-AMINOETHYL)THIO)-6-((R)-1-HYDROXYETHYL)-7-OXO-1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLATE HYDROCHLORIDE

C18H21ClN3O6S- (442.0839536000001)


   

1,3-Dioxo-1,3-dihydro-2-benzofuran-5-carboxylic acid - 1,1-methy lenebis(4-isocyanatobenzene) (1:1)

1,3-Dioxo-1,3-dihydro-2-benzofuran-5-carboxylic acid - 1,1-methy lenebis(4-isocyanatobenzene) (1:1)

C24H14N2O7 (442.0800974)


   

2-(Ethoxycarbonyl)ethyltriphenylphosphonium bromide

2-(Ethoxycarbonyl)ethyltriphenylphosphonium bromide

C23H24BrO2P (442.0697194)


   

Piflufolastat F-18

Piflufolastat F-18

C18H23FN4O8 (442.14998499999996)


V - Various > V09 - Diagnostic radiopharmaceuticals > V09I - Tumour detection C1446 - Radiopharmaceutical Compound > C2124 - Radioconjugate

   

5-(5-(3-(Trifluoromethyl)-4-(((2S)-1,1,1-trifluoropropan-2-yl)oxy)phenyl)-1,2,4-oxadiazol-3-yl)-1H-benzimidazole

5-(5-(3-(Trifluoromethyl)-4-(((2S)-1,1,1-trifluoropropan-2-yl)oxy)phenyl)-1,2,4-oxadiazol-3-yl)-1H-benzimidazole

C19H12F6N4O2 (442.08644039999996)


   

Verdinexor

Verdinexor

C18H12F6N6O (442.09767339999996)


C254 - Anti-Infective Agent > C281 - Antiviral Agent

   

(-)-Epicatechin-5-gallate

(-)-Epicatechin-5-gallate

C22H18O10 (442.0899928)


A gallate ester resulting from the formal condensation of gallic acid with 5-hydroxy group of (-)-epicatechin. Isolated from Orostachys japonica, it acts as an inhibitor of the enzyme mu-calpain (EC 3.4.22.52).

   

s-(p-Nitrobenzyl)glutathione

Glycine, L-g-glutamyl-S-[(4-nitrophenyl)methyl]-L-cysteinyl-

C17H22N4O8S (442.1158292)


   

N-{2,4-Difluoro-3-[(5-Pyridin-3-Yl-1h-Pyrrolo[2,3-B]pyridin-3-Yl)carbonyl]phenyl}ethanesulfonamide

N-{2,4-Difluoro-3-[(5-Pyridin-3-Yl-1h-Pyrrolo[2,3-B]pyridin-3-Yl)carbonyl]phenyl}ethanesulfonamide

C21H16F2N4O3S (442.09111299999995)


   

2-[[4-(2-Carboxyethyl)-2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;iron(4+)

2-[[4-(2-Carboxyethyl)-2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;iron(4+)

C23H18FeN2O4+2 (442.0615898)


   

863-03-6

Benzoic acid, 3,4,5-trihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, cis-

C22H18O10 (442.0899928)


D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

E3893_SIAL

Benzoic acid, 3,4,5-trihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-cis)-

C22H18O10 (442.0899928)


D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

(+)-Catechin gallate

(+)-Catechin gallate

C22H18O10 (442.0899928)


   

Rondomycin

Rondomycin

C22H22N2O8 (442.1376092)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents

   

5a,11a-Dehydrotetracycline

5a,11a-Dehydrotetracycline

C22H22N2O8 (442.1376092)


   

carboxy-S-adenosyl-L-methionine

carboxy-S-adenosyl-L-methionine

C16H22N6O7S (442.1270622)


   
   

(E)-2-(4-(3-(2-Chloro-9H-thioxanthen-9-ylidene)propyl)piperazin-1-YL)ethyl acetate

(E)-2-(4-(3-(2-Chloro-9H-thioxanthen-9-ylidene)propyl)piperazin-1-YL)ethyl acetate

C24H27ClN2O2S (442.14816720000005)


   

(4S,4aR,5S,5aR,12aR)-4-(dimethylamino)-5,10,11,12a-tetrahydroxy-6-methylidene-1,3,12-trioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide

(4S,4aR,5S,5aR,12aR)-4-(dimethylamino)-5,10,11,12a-tetrahydroxy-6-methylidene-1,3,12-trioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide

C22H22N2O8 (442.1376092)


   

(-)-sanguinolignan C

(-)-sanguinolignan C

C23H22O9 (442.1263762)


A lignan isolated from the leaves of Piper sanguineispicum.

   

3-(2-chlorophenyl)-6-[4-methoxy-3-(3-oxolanyloxy)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

3-(2-chlorophenyl)-6-[4-methoxy-3-(3-oxolanyloxy)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

C21H19ClN4O3S (442.0866334000001)


   

2-[(chloroacetyl)(4-methoxyphenyl)amino]-N-(2-phenylethyl)-2-thien-2-ylacetamide

2-[(chloroacetyl)(4-methoxyphenyl)amino]-N-(2-phenylethyl)-2-thien-2-ylacetamide

C23H23ClN2O3S (442.1117838)


   

(6-Bromo-5-methoxy-2-methyl-3-benzofuranyl)-[4-(2-methylphenyl)-1-piperazinyl]methanone

(6-Bromo-5-methoxy-2-methyl-3-benzofuranyl)-[4-(2-methylphenyl)-1-piperazinyl]methanone

C22H23BrN2O3 (442.0891948)


   

2-[(chloroacetyl)(3-methoxyphenyl)amino]-N-(2-phenylethyl)-2-thien-2-ylacetamide

2-[(chloroacetyl)(3-methoxyphenyl)amino]-N-(2-phenylethyl)-2-thien-2-ylacetamide

C23H23ClN2O3S (442.1117838)


   

4-methyl-N-(2-phenylphenyl)-3-(phenylsulfamoyl)benzamide

4-methyl-N-(2-phenylphenyl)-3-(phenylsulfamoyl)benzamide

C26H22N2O3S (442.1351062)


   

1-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(4-fluorophenyl)sulfonylpiperazine

1-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(4-fluorophenyl)sulfonylpiperazine

C18H19FN2O6S2 (442.0668526)


   

N-(3-methoxyphenyl)-1-[4-(1-tetrazolyl)phenyl]sulfonyl-3-piperidinecarboxamide

N-(3-methoxyphenyl)-1-[4-(1-tetrazolyl)phenyl]sulfonyl-3-piperidinecarboxamide

C20H22N6O4S (442.14231720000004)


   

2-[[2-[4-(4-Chlorophenyl)-1-piperazinyl]-2-oxoethyl]thio]-3-ethyl-4-quinazolinone

2-[[2-[4-(4-Chlorophenyl)-1-piperazinyl]-2-oxoethyl]thio]-3-ethyl-4-quinazolinone

C22H23ClN4O2S (442.1230168)


   

2-[(3-ethyl-7-methyl-4-oxo-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-2-yl)thio]-N-(2-phenylethyl)acetamide

2-[(3-ethyl-7-methyl-4-oxo-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-2-yl)thio]-N-(2-phenylethyl)acetamide

C22H26N4O2S2 (442.1497096)


   

4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[[2-(2-pyridinyl)-1-benzimidazolyl]methyl]-1H-1,2,4-triazole-5-thione

4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[[2-(2-pyridinyl)-1-benzimidazolyl]methyl]-1H-1,2,4-triazole-5-thione

C23H18N6O2S (442.12118879999997)


   

3-[[[[3-[(4-Chlorophenyl)methyl]-2-methyl-4-oxo-6-quinazolinyl]amino]-oxomethyl]amino]propanoic acid ethyl ester

3-[[[[3-[(4-Chlorophenyl)methyl]-2-methyl-4-oxo-6-quinazolinyl]amino]-oxomethyl]amino]propanoic acid ethyl ester

C22H23ClN4O4 (442.14077480000003)


   

1-Butyl-2-[(5-phenyl-2-oxazolyl)methylthio]-5-benzimidazolesulfonamide

1-Butyl-2-[(5-phenyl-2-oxazolyl)methylthio]-5-benzimidazolesulfonamide

C21H22N4O3S2 (442.1133262)


   

3-[(4-methyl-1-piperazinyl)sulfonyl]-N-(4-phenyl-2-thiazolyl)benzamide

3-[(4-methyl-1-piperazinyl)sulfonyl]-N-(4-phenyl-2-thiazolyl)benzamide

C21H22N4O3S2 (442.1133262)


   

1-(4-Chlorophenyl)-5-[[4-(4-morpholinyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

1-(4-Chlorophenyl)-5-[[4-(4-morpholinyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

C21H19ClN4O3S (442.0866334000001)


   

N-[3-[[2-(2-bromo-4,6-dimethylphenoxy)-1-oxoethyl]amino]phenyl]-2-furancarboxamide

N-[3-[[2-(2-bromo-4,6-dimethylphenoxy)-1-oxoethyl]amino]phenyl]-2-furancarboxamide

C21H19BrN2O4 (442.05281140000005)


   

N-[2-(cyclopentylamino)-1-(5-methyl-2-furanyl)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]-4-thiadiazolecarboxamide

N-[2-(cyclopentylamino)-1-(5-methyl-2-furanyl)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]-4-thiadiazolecarboxamide

C22H23FN4O3S (442.14748199999997)


   

[1-(2,1,3-Benzothiadiazol-4-ylsulfonyl)-3-piperidinyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone

[1-(2,1,3-Benzothiadiazol-4-ylsulfonyl)-3-piperidinyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone

C21H22N4O3S2 (442.1133262)


   

[5-(2-Furanyl)-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone

[5-(2-Furanyl)-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone

C21H17F3N6O2 (442.13650179999996)


   

2-[2-chloro-4-(methylsulfonyl)-3-{[(2R)-tetrahydrofuran-2-ylmethoxy]methyl}benzoyl]cyclohexane-1,3-dione

2-[2-chloro-4-(methylsulfonyl)-3-{[(2R)-tetrahydrofuran-2-ylmethoxy]methyl}benzoyl]cyclohexane-1,3-dione

C20H23ClO7S (442.08529580000004)


   

[4-[Bis(4-fluorophenyl)methyl]-1-piperazinyl]-(5-methyl-4-nitro-3-isoxazolyl)methanone

[4-[Bis(4-fluorophenyl)methyl]-1-piperazinyl]-(5-methyl-4-nitro-3-isoxazolyl)methanone

C22H20F2N4O4 (442.14525440000006)


   

(1R,5S)-6-(4-chlorophenyl)sulfonyl-7-[4-(3-fluorophenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane

(1R,5S)-6-(4-chlorophenyl)sulfonyl-7-[4-(3-fluorophenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane

C23H20ClFN2O2S (442.0917982)


   

methyl (1S,3R)-2-(chloroacetyl)-1-[4-(methoxycarbonyl)phenyl]-2,3,4,4a,9,9a-hexahydro-1H-beta-carboline-3-carboxylate

methyl (1S,3R)-2-(chloroacetyl)-1-[4-(methoxycarbonyl)phenyl]-2,3,4,4a,9,9a-hexahydro-1H-beta-carboline-3-carboxylate

C23H23ClN2O5 (442.1295418)


   

2-chloro-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

2-chloro-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

C19H27ClN4O4S (442.1441452)


   

2-chloro-N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

2-chloro-N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

C19H27ClN4O4S (442.1441452)


   

2-chloro-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

2-chloro-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

C19H27ClN4O4S (442.1441452)


   

2-chloro-N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

2-chloro-N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

C19H27ClN4O4S (442.1441452)


   

2-chloro-N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

2-chloro-N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

C19H27ClN4O4S (442.1441452)


   

2-chloro-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

2-chloro-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

C19H27ClN4O4S (442.1441452)


   

2-chloro-N-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

2-chloro-N-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

C19H27ClN4O4S (442.1441452)


   

2-chloro-N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

2-chloro-N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide

C19H27ClN4O4S (442.1441452)


   

2-[2-chloro-4-(methylsulfonyl)-3-{[(2S)-tetrahydrofuran-2-ylmethoxy]methyl}benzoyl]cyclohexane-1,3-dione

2-[2-chloro-4-(methylsulfonyl)-3-{[(2S)-tetrahydrofuran-2-ylmethoxy]methyl}benzoyl]cyclohexane-1,3-dione

C20H23ClO7S (442.08529580000004)


   

6-[2-[4,6-Dihydroxy-2-methoxy-3-(3-methylbut-2-enyl)phenyl]acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

6-[2-[4,6-Dihydroxy-2-methoxy-3-(3-methylbut-2-enyl)phenyl]acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

C20H26O11 (442.14750460000005)


   

6-[6-[(2-Carboxyacetyl)oxymethyl]-2,4,5-trihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

6-[6-[(2-Carboxyacetyl)oxymethyl]-2,4,5-trihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

C15H22O15 (442.09586620000005)


   

1-[(Z)-(1-acetyl-6-hydroxyspiro[3H-chromene-2,4-piperidine]-4-ylidene)amino]-3-(2-fluorophenyl)thiourea

1-[(Z)-(1-acetyl-6-hydroxyspiro[3H-chromene-2,4-piperidine]-4-ylidene)amino]-3-(2-fluorophenyl)thiourea

C22H23FN4O3S (442.14748199999997)


   

2-[2-(2,5-difluoroanilino)-2-hydroxyethyl]sulfanyl-3-ethyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one

2-[2-(2,5-difluoroanilino)-2-hydroxyethyl]sulfanyl-3-ethyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one

C22H20F2N4O2S (442.12749640000004)


   

[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (3R)-3-isocyanobutanoate

[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (3R)-3-isocyanobutanoate

C15H19N6O8P (442.1001944)


   

3-[(4aS,12aR)-2-methyl-1,3,4,5,12,12a-hexahydropyrido[3,4-b]acridin-4a-yl]phenol;hydrate;hydrobromide

3-[(4aS,12aR)-2-methyl-1,3,4,5,12,12a-hexahydropyrido[3,4-b]acridin-4a-yl]phenol;hydrate;hydrobromide

C23H27BrN2O2 (442.1255782)


   

15-(1,3-Dihydroxy-3-methylbutyl)-4,18-dihydroxy-2-methoxy-7,9,13-trioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),5,11,14,16,18-heptaen-20-one

15-(1,3-Dihydroxy-3-methylbutyl)-4,18-dihydroxy-2-methoxy-7,9,13-trioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),5,11,14,16,18-heptaen-20-one

C23H22O9 (442.1263762)


   

(4R,4aR,5R,5aR,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methylidene-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide

(4R,4aR,5R,5aR,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methylidene-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide

C22H22N2O8 (442.1376092)


   

(-)-epicatechingallate

(-)-epicatechingallate

C22H18O10 (442.0899928)


   

epicatechin-3-gallate

epicatechin-3-gallate

C22H18O10 (442.0899928)


D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents

   
   

S-adenosyl-S-carboxymethyl-L-homocysteine dizwitterion

S-adenosyl-S-carboxymethyl-L-homocysteine dizwitterion

C16H22N6O7S (442.1270622)


A sulfonium betaine obtained by deprotonation of the carboxy groups and protonation of the amino group of S-adenosyl-S-carboxymethyl-L-homocysteine. Major microspecies at pH 7.3

   

12-dehydrotetracycline zwitterion

12-dehydrotetracycline zwitterion

C22H22N2O8 (442.1376092)


Zwitterionic form of 12-dehydrotetracycline arising from transfer of a proton from the 2-hydroxy group to the adjacent tertiary amino group.

   

(+)-epicatechin-3-O-gallate

(+)-epicatechin-3-O-gallate

C22H18O10 (442.0899928)


A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3S)-hydroxy group of (+)-epicatechin.

   

(+)-catechin-3-O-gallate

(+)-catechin-3-O-gallate

C22H18O10 (442.0899928)


A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3S)-hydroxy group of (+)-catechin.

   
   
   
   
   

PF-739

PF-739

C23H23ClN2O5 (442.1295418)


PF-739 is an orally active and non-selective activator of AMPK. PF-739 activates 12 heterotrimeric AMPK complexes and significantly reduces the level of glucose in plasma complexes[1][2].

   

2,3,7,12,15,16-hexahydroxy-17-(hydroxymethyl)-9,13-dimethyl-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-9-ene-4,11-dione

2,3,7,12,15,16-hexahydroxy-17-(hydroxymethyl)-9,13-dimethyl-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-9-ene-4,11-dione

C20H26O11 (442.14750460000005)


   

(2s,3r,4s,5s,6r)-6-({[(2s,3r,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl (2e)-3-phenylprop-2-enoate

(2s,3r,4s,5s,6r)-6-({[(2s,3r,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl (2e)-3-phenylprop-2-enoate

C20H26O11 (442.14750460000005)


   

3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl 3-phenylprop-2-enoate

3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl 3-phenylprop-2-enoate

C20H26O11 (442.14750460000005)


   

(2s)-4-hydroxy-3-methylidene-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

(2s)-4-hydroxy-3-methylidene-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl 3-phenylprop-2-enoate

6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl 3-phenylprop-2-enoate

C20H26O11 (442.14750460000005)


   

5-(6-hydroxy-1-benzofuran-2-yl)-2-{5-hydroxy-9-methyl-8-oxatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-11-yl}benzene-1,3-diol

5-(6-hydroxy-1-benzofuran-2-yl)-2-{5-hydroxy-9-methyl-8-oxatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-11-yl}benzene-1,3-diol

C27H22O6 (442.1416312)


   

5,7-dihydroxy-3,6-dimethoxy-2-(4-methoxyphenyl)-4-oxochromen-8-yl 2-methylbut-2-enoate

5,7-dihydroxy-3,6-dimethoxy-2-(4-methoxyphenyl)-4-oxochromen-8-yl 2-methylbut-2-enoate

C23H22O9 (442.1263762)


   

(2s)-1-(acetyloxy)-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

(2s)-1-(acetyloxy)-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

3- o -galloyl- ent -catechin

NA

C22H18O10 (442.0899928)


{"Ingredient_id": "HBIN009326","Ingredient_name": "3- o -galloyl- ent -catechin","Alias": "NA","Ingredient_formula": "C22H18O10","Ingredient_Smile": "NA","Ingredient_weight": "442.378","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8512","PubChem_id": "NA","DrugBank_id": "NA"}

   

(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl (2e)-3-phenylprop-2-enoate

(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl (2e)-3-phenylprop-2-enoate

C20H26O11 (442.14750460000005)


   

(2s,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 2,3,4-trihydroxybenzoate

(2s,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 2,3,4-trihydroxybenzoate

C22H18O10 (442.0899928)


   

(3s)-3-hydroxy-2-methylidene-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

(3s)-3-hydroxy-2-methylidene-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

2-amino-4-[(1-carboxy-2-{[3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-en-1-yl]sulfanyl}ethyl)-c-hydroxycarbonimidoyl]butanoic acid

2-amino-4-[(1-carboxy-2-{[3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-en-1-yl]sulfanyl}ethyl)-c-hydroxycarbonimidoyl]butanoic acid

C19H26N2O8S (442.14097960000004)


   

4-[(10r,11r,15r,16r)-16-hydroxy-12-oxo-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-10-yl]-2,6-dimethoxyphenyl acetate

4-[(10r,11r,15r,16r)-16-hydroxy-12-oxo-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-10-yl]-2,6-dimethoxyphenyl acetate

C23H22O9 (442.1263762)


   

(2r,3s,4s,5r,6r)-4,5-dihydroxy-6-{[(2e)-4-hydroxy-2-(hydroxymethyl)but-2-en-1-yl]oxy}-2-(hydroxymethyl)oxan-3-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

(2r,3s,4s,5r,6r)-4,5-dihydroxy-6-{[(2e)-4-hydroxy-2-(hydroxymethyl)but-2-en-1-yl]oxy}-2-(hydroxymethyl)oxan-3-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

13-bromo-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-3,4,7,8,9,10-hexahydro-2-benzoxacyclotetradecin-1-one

13-bromo-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-3,4,7,8,9,10-hexahydro-2-benzoxacyclotetradecin-1-one

C19H23BrO7 (442.0627068)


   

2-(3,4-dimethoxyphenyl)-5,7-dihydroxy-8-methoxy-4-oxochromen-3-yl 2-methylbut-2-enoate

2-(3,4-dimethoxyphenyl)-5,7-dihydroxy-8-methoxy-4-oxochromen-3-yl 2-methylbut-2-enoate

C23H22O9 (442.1263762)


   

methyl (1s,2s,4r)-2,4,5,7,12-pentahydroxy-6,11-dioxo-2-propyl-3,4-dihydro-1h-tetracene-1-carboxylate

methyl (1s,2s,4r)-2,4,5,7,12-pentahydroxy-6,11-dioxo-2-propyl-3,4-dihydro-1h-tetracene-1-carboxylate

C23H22O9 (442.1263762)


   

7,7'-dihydroxy-6,6',8,8'-tetramethoxy-[4,4'-bichromene]-2,2'-dione

7,7'-dihydroxy-6,6',8,8'-tetramethoxy-[4,4'-bichromene]-2,2'-dione

C22H18O10 (442.0899928)


   

catechin 4'-o-gallate

catechin 4'-o-gallate

C22H18O10 (442.0899928)


   

3-(acetyloxy)-2-[4-(acetyloxy)phenyl]-5-methoxy-6-methyl-4-oxo-2,3-dihydro-1-benzopyran-7-yl acetate

3-(acetyloxy)-2-[4-(acetyloxy)phenyl]-5-methoxy-6-methyl-4-oxo-2,3-dihydro-1-benzopyran-7-yl acetate

C23H22O9 (442.1263762)


   

1,11-bis(methylsulfanyl)-2,12-dioxo-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icosa-6,8,14,16,18-pentaen-5-yl acetate

1,11-bis(methylsulfanyl)-2,12-dioxo-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icosa-6,8,14,16,18-pentaen-5-yl acetate

C22H22N2O4S2 (442.1020932)


   

3-(acetyloxy)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl 3-(4-hydroxyphenyl)prop-2-enoate

3-(acetyloxy)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl 3-(4-hydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

5-benzoyl-4-hydroxy-2-(2-hydroxypropan-2-yl)-9-phenyl-2h,3h-furo[2,3-f]chromen-7-one

5-benzoyl-4-hydroxy-2-(2-hydroxypropan-2-yl)-9-phenyl-2h,3h-furo[2,3-f]chromen-7-one

C27H22O6 (442.1416312)


   

(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(2r,4r)-2-methyl-6-oxooxan-4-yl]oxy}oxan-3-yl 2-(3,4-dihydroxyphenyl)acetate

(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(2r,4r)-2-methyl-6-oxooxan-4-yl]oxy}oxan-3-yl 2-(3,4-dihydroxyphenyl)acetate

C20H26O11 (442.14750460000005)


   

[(2r,3r)-3-(3,4-dimethoxyphenyl)-5-methoxy-9-oxo-2h,3h-[1,4]dioxino[2,3-h]chromen-2-yl]methyl acetate

[(2r,3r)-3-(3,4-dimethoxyphenyl)-5-methoxy-9-oxo-2h,3h-[1,4]dioxino[2,3-h]chromen-2-yl]methyl acetate

C23H22O9 (442.1263762)


   

2-{3,4-dihydroxy-2,5-bis[(2-hydroxyethyl)sulfanyl]phenyl}-3,4-dihydro-2h-1-benzopyran-3,5,7-triol

2-{3,4-dihydroxy-2,5-bis[(2-hydroxyethyl)sulfanyl]phenyl}-3,4-dihydro-2h-1-benzopyran-3,5,7-triol

C19H22O8S2 (442.0756052)


   

4-(3,5-dimethoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-tetrahydro-3h-furo[3,4-c]furan-1-one

4-(3,5-dimethoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-tetrahydro-3h-furo[3,4-c]furan-1-one

C20H26O11 (442.14750460000005)


   

6-methyl-8a-({5-oxo-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2h-furan-3-yl}methyl)-tetrahydro-3h-furo[3,4-c]oxepine-1,8-dione

6-methyl-8a-({5-oxo-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2h-furan-3-yl}methyl)-tetrahydro-3h-furo[3,4-c]oxepine-1,8-dione

C20H26O11 (442.14750460000005)


   

(2s,3r,4s,5s,6r)-6-({[(2r,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl (2e)-3-phenylprop-2-enoate

(2s,3r,4s,5s,6r)-6-({[(2r,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl (2e)-3-phenylprop-2-enoate

C20H26O11 (442.14750460000005)


   

(3as,4r,6as)-4-(3,5-dimethoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-tetrahydro-3h-furo[3,4-c]furan-1-one

(3as,4r,6as)-4-(3,5-dimethoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-tetrahydro-3h-furo[3,4-c]furan-1-one

C20H26O11 (442.14750460000005)


   

3-hydroxy-2-methylidene-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl 3-(3,4-dihydroxyphenyl)prop-2-enoate

3-hydroxy-2-methylidene-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl 3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

[3-(3,4-dimethoxyphenyl)-5-methoxy-9-oxo-2h,3h-[1,4]dioxino[2,3-h]chromen-2-yl]methyl acetate

[3-(3,4-dimethoxyphenyl)-5-methoxy-9-oxo-2h,3h-[1,4]dioxino[2,3-h]chromen-2-yl]methyl acetate

C23H22O9 (442.1263762)


   

(2r)-5-hydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-yl 3,4,5-trihydroxybenzoate

(2r)-5-hydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   

(1s,6r,13r,21s)-10,13,21-trihydroxy-16,17-dimethoxy-6-(prop-1-en-2-yl)-2,7,20-trioxapentacyclo[11.8.0.0³,¹¹.0⁴,⁸.0¹⁴,¹⁹]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one

(1s,6r,13r,21s)-10,13,21-trihydroxy-16,17-dimethoxy-6-(prop-1-en-2-yl)-2,7,20-trioxapentacyclo[11.8.0.0³,¹¹.0⁴,⁸.0¹⁴,¹⁹]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one

C23H22O9 (442.1263762)


   

1,4-dimethyl 2-(2h-1,3-benzodioxol-5-ylmethylidene)-3-[(7-methoxy-2h-1,3-benzodioxol-5-yl)methyl]butanedioate

1,4-dimethyl 2-(2h-1,3-benzodioxol-5-ylmethylidene)-3-[(7-methoxy-2h-1,3-benzodioxol-5-yl)methyl]butanedioate

C23H22O9 (442.1263762)


   

(2s)-3-(acetyloxy)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

(2s)-3-(acetyloxy)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-5-yl 3,4,5-trihydroxybenzoate

2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-5-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   

(2r,3r)-2-{3,4-dihydroxy-2,5-bis[(2-hydroxyethyl)sulfanyl]phenyl}-3,4-dihydro-2h-1-benzopyran-3,5,7-triol

(2r,3r)-2-{3,4-dihydroxy-2,5-bis[(2-hydroxyethyl)sulfanyl]phenyl}-3,4-dihydro-2h-1-benzopyran-3,5,7-triol

C19H22O8S2 (442.0756052)


   

(2s)-5-hydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-yl 3,4,5-trihydroxybenzoate

(2s)-5-hydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   

(1s,2s,3s,4s,5r,6s)-5-(acetyloxy)-6-[(benzoyloxy)methyl]-2,4-dihydroxy-7-oxabicyclo[4.1.0]heptan-3-yl benzoate

(1s,2s,3s,4s,5r,6s)-5-(acetyloxy)-6-[(benzoyloxy)methyl]-2,4-dihydroxy-7-oxabicyclo[4.1.0]heptan-3-yl benzoate

C23H22O9 (442.1263762)


   

(2r)-5-benzoyl-4-hydroxy-2-(2-hydroxypropan-2-yl)-9-phenyl-2h,3h-furo[2,3-f]chromen-7-one

(2r)-5-benzoyl-4-hydroxy-2-(2-hydroxypropan-2-yl)-9-phenyl-2h,3h-furo[2,3-f]chromen-7-one

C27H22O6 (442.1416312)


   

3-hydroxy-2-{[hydroxy(4-hydroxy-1-methyl-2-oxopteridin-6-yl)methylidene]amino}-n-[2-(methoxycarbonyl)phenyl]propanimidic acid

3-hydroxy-2-{[hydroxy(4-hydroxy-1-methyl-2-oxopteridin-6-yl)methylidene]amino}-n-[2-(methoxycarbonyl)phenyl]propanimidic acid

C19H18N6O7 (442.1236918)


   

(2s)-2-amino-4-{[(1r)-1-carboxy-2-{[(2e)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-en-1-yl]sulfanyl}ethyl]-c-hydroxycarbonimidoyl}butanoic acid

(2s)-2-amino-4-{[(1r)-1-carboxy-2-{[(2e)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-en-1-yl]sulfanyl}ethyl]-c-hydroxycarbonimidoyl}butanoic acid

C19H26N2O8S (442.14097960000004)


   

2-hydroxy-4-(3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl 3,4,5-trihydroxybenzoate

2-hydroxy-4-(3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   

2,5-bis(4-hydroxyphenyl)-4-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl benzoate

2,5-bis(4-hydroxyphenyl)-4-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl benzoate

C26H18O7 (442.1052478)


   

[(2r,3s,4r,5r,6r)-3,4,5-trihydroxy-6-{[(2e)-4-hydroxy-2-(hydroxymethyl)but-2-en-1-yl]oxy}oxan-2-yl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

[(2r,3s,4r,5r,6r)-3,4,5-trihydroxy-6-{[(2e)-4-hydroxy-2-(hydroxymethyl)but-2-en-1-yl]oxy}oxan-2-yl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

1,4-dimethyl (2z)-2-(2h-1,3-benzodioxol-5-ylmethylidene)-3-[(7-methoxy-2h-1,3-benzodioxol-5-yl)methyl]butanedioate

1,4-dimethyl (2z)-2-(2h-1,3-benzodioxol-5-ylmethylidene)-3-[(7-methoxy-2h-1,3-benzodioxol-5-yl)methyl]butanedioate

C23H22O9 (442.1263762)


   

(2r)-3-(acetyloxy)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

(2r)-3-(acetyloxy)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

(2s)-3-(acetyloxy)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

(2s)-3-(acetyloxy)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

(1r,4s,5s,11r)-1,11-bis(methylsulfanyl)-2,12-dioxo-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icosa-6,8,14,16,18-pentaen-5-yl acetate

(1r,4s,5s,11r)-1,11-bis(methylsulfanyl)-2,12-dioxo-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icosa-6,8,14,16,18-pentaen-5-yl acetate

C22H22N2O4S2 (442.1020932)


   

(3,4-dihydroxy-5-{[2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}oxolan-3-yl)methyl 3-phenylprop-2-enoate

(3,4-dihydroxy-5-{[2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}oxolan-3-yl)methyl 3-phenylprop-2-enoate

C20H26O11 (442.14750460000005)


   

1,4-dimethyl (2z,3s)-2-(2h-1,3-benzodioxol-5-ylmethylidene)-3-[(7-methoxy-2h-1,3-benzodioxol-5-yl)methyl]butanedioate

1,4-dimethyl (2z,3s)-2-(2h-1,3-benzodioxol-5-ylmethylidene)-3-[(7-methoxy-2h-1,3-benzodioxol-5-yl)methyl]butanedioate

C23H22O9 (442.1263762)


   

5-(6-hydroxy-1-benzofuran-2-yl)-2-[(1r,9r)-5-hydroxy-9-methyl-8-oxatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-11-yl]benzene-1,3-diol

5-(6-hydroxy-1-benzofuran-2-yl)-2-[(1r,9r)-5-hydroxy-9-methyl-8-oxatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-11-yl]benzene-1,3-diol

C27H22O6 (442.1416312)


   

[(3s,4r,5s)-3,4-dihydroxy-5-{[(2s,3r,4s,5r,6r)-2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}oxolan-3-yl]methyl (2e)-3-phenylprop-2-enoate

[(3s,4r,5s)-3,4-dihydroxy-5-{[(2s,3r,4s,5r,6r)-2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}oxolan-3-yl]methyl (2e)-3-phenylprop-2-enoate

C20H26O11 (442.14750460000005)


   

(2z)-4-hydroxy-2-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)but-2-en-1-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

(2z)-4-hydroxy-2-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)but-2-en-1-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

6-methyl-8a-[(5-oxo-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2h-furan-3-yl)methyl]-tetrahydro-3h-furo[3,4-c]oxepine-1,8-dione

6-methyl-8a-[(5-oxo-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2h-furan-3-yl)methyl]-tetrahydro-3h-furo[3,4-c]oxepine-1,8-dione

C20H26O11 (442.14750460000005)


   

10,13,21-trihydroxy-16,17-dimethoxy-6-(prop-1-en-2-yl)-2,7,20-trioxapentacyclo[11.8.0.0³,¹¹.0⁴,⁸.0¹⁴,¹⁹]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one

10,13,21-trihydroxy-16,17-dimethoxy-6-(prop-1-en-2-yl)-2,7,20-trioxapentacyclo[11.8.0.0³,¹¹.0⁴,⁸.0¹⁴,¹⁹]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one

C23H22O9 (442.1263762)


   

(11r,15r,17r)-17-ethyl-2-hydroxy-5-[(2r,4r,6r)-4-hydroxy-6-methyl-5-oxooxan-2-yl]-12,16-dioxatetracyclo[8.7.0.0³,⁸.0¹¹,¹⁵]heptadeca-1,3(8),5,9-tetraene-4,7,13-trione

(11r,15r,17r)-17-ethyl-2-hydroxy-5-[(2r,4r,6r)-4-hydroxy-6-methyl-5-oxooxan-2-yl]-12,16-dioxatetracyclo[8.7.0.0³,⁸.0¹¹,¹⁵]heptadeca-1,3(8),5,9-tetraene-4,7,13-trione

C23H22O9 (442.1263762)


   

6,6',8,8'-tetrahydroxy-7,7'-dimethoxy-3,3'-dimethyl-[5,5'-biisochromene]-1,1'-dione

6,6',8,8'-tetrahydroxy-7,7'-dimethoxy-3,3'-dimethyl-[5,5'-biisochromene]-1,1'-dione

C22H18O10 (442.0899928)


   

3-hydroxy-2-methylidene-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

3-hydroxy-2-methylidene-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

2-(acetyloxy)-3-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}propyl 3-(3,4-dihydroxyphenyl)prop-2-enoate

2-(acetyloxy)-3-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}propyl 3-(3,4-dihydroxyphenyl)prop-2-enoate

C23H22O9 (442.1263762)


   

3-hydroxy-2-methylidene-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl (2z)-3-(3,4-dihydroxyphenyl)prop-2-enoate

3-hydroxy-2-methylidene-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl (2z)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

(2r)-2-(acetyloxy)-3-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}propyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

(2r)-2-(acetyloxy)-3-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}propyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C23H22O9 (442.1263762)


   

3-{[(2r,3s,4s,5r,6s)-6-[(7,8-dihydroxy-2-oxochromen-5-yl)oxy]-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid

3-{[(2r,3s,4s,5r,6s)-6-[(7,8-dihydroxy-2-oxochromen-5-yl)oxy]-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid

C18H18O13 (442.0747378)


   

3-[(6,8-dimethoxy-2-oxochromen-7-yl)oxy]-7-hydroxy-6,8-dimethoxychromen-2-one

3-[(6,8-dimethoxy-2-oxochromen-7-yl)oxy]-7-hydroxy-6,8-dimethoxychromen-2-one

C22H18O10 (442.0899928)


   

4-hydroxy-3-methylidene-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

4-hydroxy-3-methylidene-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

5,13,17,19-tetrahydroxy-7-pentylpentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁶,²¹]docosa-1,3(12),4(9),5,7,10,13,16,18,20-decaene-15,22-dione

5,13,17,19-tetrahydroxy-7-pentylpentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁶,²¹]docosa-1,3(12),4(9),5,7,10,13,16,18,20-decaene-15,22-dione

C27H22O6 (442.1416312)


   

(2e)-4-hydroxy-3-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)but-2-en-1-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

(2e)-4-hydroxy-3-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)but-2-en-1-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

(1r,4r,5r,6r,7r,8r,11r,13s,17s,18s,19r)-4,5,6,7,8,17-hexahydroxy-6-(hydroxymethyl)-14,18-dimethyl-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-ene-9,16-dione

(1r,4r,5r,6r,7r,8r,11r,13s,17s,18s,19r)-4,5,6,7,8,17-hexahydroxy-6-(hydroxymethyl)-14,18-dimethyl-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-ene-9,16-dione

C20H26O11 (442.14750460000005)


   

(2s)-3-hydroxy-2-{[hydroxy(4-hydroxy-1-methyl-2-oxopteridin-6-yl)methylidene]amino}-n-[2-(methoxycarbonyl)phenyl]propanimidic acid

(2s)-3-hydroxy-2-{[hydroxy(4-hydroxy-1-methyl-2-oxopteridin-6-yl)methylidene]amino}-n-[2-(methoxycarbonyl)phenyl]propanimidic acid

C19H18N6O7 (442.1236918)


   

1-(acetyloxy)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl 3-(4-hydroxyphenyl)prop-2-enoate

1-(acetyloxy)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl 3-(4-hydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 2,3,4-trihydroxybenzoate

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 2,3,4-trihydroxybenzoate

C22H18O10 (442.0899928)


   

4-hydroxy-3-methylidene-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate

4-hydroxy-3-methylidene-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

3-({6-[(7,8-dihydroxy-2-oxochromen-5-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methoxy)-3-oxopropanoic acid

3-({6-[(7,8-dihydroxy-2-oxochromen-5-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methoxy)-3-oxopropanoic acid

C18H18O13 (442.0747378)


   

2,7-dihydroxy-1-methoxy-4,6,11-trioxo-3-propanoyl-4a,12-dihydro-1h-5-oxatetracene-12a-carboxylic acid

2,7-dihydroxy-1-methoxy-4,6,11-trioxo-3-propanoyl-4a,12-dihydro-1h-5-oxatetracene-12a-carboxylic acid

C22H18O10 (442.0899928)


   

methyl 2,4,5,7,12-pentahydroxy-6,11-dioxo-2-propyl-3,4-dihydro-1h-tetracene-1-carboxylate

methyl 2,4,5,7,12-pentahydroxy-6,11-dioxo-2-propyl-3,4-dihydro-1h-tetracene-1-carboxylate

C23H22O9 (442.1263762)


   

catechin 3'-o-gallate

catechin 3'-o-gallate

C22H18O10 (442.0899928)


   

3-(acetyloxy)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

3-(acetyloxy)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(2r,4r)-2-methyl-6-oxooxan-4-yl]oxy}oxan-3-yl 2-(3,4-dihydroxyphenyl)acetate

(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(2r,4r)-2-methyl-6-oxooxan-4-yl]oxy}oxan-3-yl 2-(3,4-dihydroxyphenyl)acetate

C20H26O11 (442.14750460000005)


   

(2r,3r,4r,5r,6r)-3,5-dihydroxy-2-{[(2e)-4-hydroxy-2-(hydroxymethyl)but-2-en-1-yl]oxy}-6-(hydroxymethyl)oxan-4-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

(2r,3r,4r,5r,6r)-3,5-dihydroxy-2-{[(2e)-4-hydroxy-2-(hydroxymethyl)but-2-en-1-yl]oxy}-6-(hydroxymethyl)oxan-4-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

4,5,6,7,8,17-hexahydroxy-6-(hydroxymethyl)-14,18-dimethyl-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-ene-9,16-dione

4,5,6,7,8,17-hexahydroxy-6-(hydroxymethyl)-14,18-dimethyl-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-ene-9,16-dione

C20H26O11 (442.14750460000005)


   

2-hydroxy-5-(3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl 3,4,5-trihydroxybenzoate

2-hydroxy-5-(3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl 3,4,5-trihydroxybenzoate

C22H18O10 (442.0899928)


   

4-hydroxy-2-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)but-2-en-1-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate

4-hydroxy-2-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)but-2-en-1-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

(2s,3s)-3-(acetyloxy)-2-[4-(acetyloxy)phenyl]-5-methoxy-6-methyl-4-oxo-2,3-dihydro-1-benzopyran-7-yl acetate

(2s,3s)-3-(acetyloxy)-2-[4-(acetyloxy)phenyl]-5-methoxy-6-methyl-4-oxo-2,3-dihydro-1-benzopyran-7-yl acetate

C23H22O9 (442.1263762)


   

[4-(2h-1,3-benzodioxole-5-carbonyl)-5-oxooxolan-3-yl](3,4-dimethoxyphenyl)methyl acetate

[4-(2h-1,3-benzodioxole-5-carbonyl)-5-oxooxolan-3-yl](3,4-dimethoxyphenyl)methyl acetate

C23H22O9 (442.1263762)


   

4-hydroxy-3-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)but-2-en-1-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate

4-hydroxy-3-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)but-2-en-1-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate

C20H26O11 (442.14750460000005)


   

5-(6-hydroxy-1-benzofuran-2-yl)-2-[(1s,9s)-5-hydroxy-9-methyl-8-oxatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-11-yl]benzene-1,3-diol

5-(6-hydroxy-1-benzofuran-2-yl)-2-[(1s,9s)-5-hydroxy-9-methyl-8-oxatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-11-yl]benzene-1,3-diol

C27H22O6 (442.1416312)


   

methyl 4-[(1,4-dioxonaphthalen-2-yl)oxy]-1-hydroxy-3-(3-methylbut-2-en-1-yl)naphthalene-2-carboxylate

methyl 4-[(1,4-dioxonaphthalen-2-yl)oxy]-1-hydroxy-3-(3-methylbut-2-en-1-yl)naphthalene-2-carboxylate

C27H22O6 (442.1416312)