Exact Mass: 628.278452
Exact Mass Matches: 628.278452
Found 275 metabolites which its exact mass value is equals to given mass value 628.278452
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Gambogic acid
Isolated from Gamboge resin (exudate of Garcinia morella). Gambogic acid is found in herbs and spices and fruits. Gambogic acid is found in fruits. Gambogic acid is isolated from Gamboge resin (exudate of Garcinia morella). Gambogic Acid (Beta-Guttiferrin) is derived from the gamboges resin of the tree Garcinia hanburyi. Gambogic Acid (Beta-Guttiferrin) inhibits Bcl-XL, Bcl-2, Bcl-W, Bcl-B, Bfl-1 and Mcl-1 with IC50s of 1.47 μM, 1.21 μM, 2.02 μM, 0.66 μM, 1.06 μM and 0.79 μM. Gambogic Acid (Beta-Guttiferrin) is derived from the gamboges resin of the tree Garcinia hanburyi. Gambogic Acid (Beta-Guttiferrin) inhibits Bcl-XL, Bcl-2, Bcl-W, Bcl-B, Bfl-1 and Mcl-1 with IC50s of 1.47 μM, 1.21 μM, 2.02 μM, 0.66 μM, 1.06 μM and 0.79 μM.
Resiniferatoxin
Resiniferatoxin is a heteropentacyclic compound found in Euphorbia poissonii with molecular formula C37H40O9. It is an agonist of the transient receptor potential cation channel subfamily V member 1 (TrpV1). It has a role as a TRPV1 agonist, a plant metabolite, a neurotoxin and an analgesic. It is a diterpenoid, an ortho ester, a tertiary alpha-hydroxy ketone, a member of phenols, a monomethoxybenzene, an organic heteropentacyclic compound, a carboxylic ester and an enone. Resiniferatoxin (RTX) is a naturally occurring, ultrapotent capsaicin analog that activates the vanilloid receptor in a subpopulation of primary afferent sensory neurons involved in nociception (the transmission of physiological pain). Resiniferatoxin is a natural product found in Euphorbia resinifera and Euphorbia unispina with data available. Resiniferatoxin is a naturally occurring capsaicin analog found in the latex of the cactus Euphorbia resinifera with analgesic activity. Resiniferatoxin (RTX) binds to and activates the transient receptor potential vanilloid 1 (TRPV1), a non-selective cation channel in the plasma membrane of primary afferent sensory neurons. This increases the permeability to cations, and leads to an influx of calcium and sodium ions. This results in membrane depolarization, causing an irritant effect, followed by desensitization of the sensory neurons thereby inhibiting signal conduction in afferent pain pathways and causing analgesia. TRPV1, a member of the transient receptor potential channel (TRP) superfamily, is a heat- and chemo-sensitive calcium/sodium ion channel that is selectively expressed in a subpopulation of pain-sensing primary afferent neurons. A heteropentacyclic compound found in Euphorbia poissonii with molecular formula C37H40O9. It is an agonist of the transient receptor potential cation channel subfamily V member 1 (TrpV1). C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic
Capsicum annuum Fluorescent chlorophyll catabolite
Chlorophyll catabolite isolated from Capsicum annuum (ripe sweet pepper). Capsicum annuum Fluorescent chlorophyll catabolite is found in many foods, some of which are italian sweet red pepper, herbs and spices, orange bell pepper, and red bell pepper. Brassica napus fluorescent chlorophyll catabolite is found in brassicas. Chlorophyll catabolite isolated from Brassica napu
Resiniferatoxin
Gambogic_acid
beta-Guttiferin is a natural product found in Garcinia hanburyi with data available. Gambogic Acid (Beta-Guttiferrin) is derived from the gamboges resin of the tree Garcinia hanburyi. Gambogic Acid (Beta-Guttiferrin) inhibits Bcl-XL, Bcl-2, Bcl-W, Bcl-B, Bfl-1 and Mcl-1 with IC50s of 1.47 μM, 1.21 μM, 2.02 μM, 0.66 μM, 1.06 μM and 0.79 μM. Gambogic Acid (Beta-Guttiferrin) is derived from the gamboges resin of the tree Garcinia hanburyi. Gambogic Acid (Beta-Guttiferrin) inhibits Bcl-XL, Bcl-2, Bcl-W, Bcl-B, Bfl-1 and Mcl-1 with IC50s of 1.47 μM, 1.21 μM, 2.02 μM, 0.66 μM, 1.06 μM and 0.79 μM.
gambogellic acid
Gambogellic
Neocalycopterone methyl ether
(+)-(2R,3S,4R,5R,2S)-1-[2,3,4,5-tetrahydro-5-hydroxy-2-(4-methoxyphenyl)-6-methoxy-7,8-methylenedioxy-10-oxo-3-phenyl-2,5-methano-1-benzoxepin-4-carbonyl]-2-(2-methylpropanoylamino)-pyrrolidine|thapsakon A
juncenolide I|rel-(1R,2R,3aR,4S,8S,8aS,9S,11R,12aS,13S,13aR)-9,11,13-tris(acetyloxy)-4-chlorotetradecahydro-13a-hydroxy-1,8a-dimethyl-5-methylene-2-oxospiro[benzo[4,5]cyclodeca[1,2-b]furan-12(2H),2-oxiran]-8-yl 2-methylpropanoate
C30H41ClO12 (628.2286416000001)
20-O-[N-(2-aminobenzoyl)]anthraniloyl-3-O-acetylingenol
7,13-dideacetyl-2,9,10-debenzoyl-2-tigloyl-7beta,9alpha-p-hydroxybenzylidenedioxy-taxchinin
1beta,2beta,3alpha,5alpha,7beta,8beta,11-heptaacetoxydihydroagarofuran
3beta-detigloyoxy-2-methylbutanoyloxy xylogranatin B|xylogranatin C
aeruginosin GE642|D-m,m-di-Cl-p-Hpla-D-Leu-L-Choi-agmatine
(4aS,10aS)-6-{2-[2-(acetyloxy)-3-hydroxy-1-oxo-3-phenylpropyl]-3-hydroxy-5-methoxyphenoxy}-2,3,4,4a,10,10a-hexahydro-1,1,4a-trimethyl-7-(1-methylethyl)phenanthren-9(1H)-one|salicassin
13,17-O-Diacetyl-5-O-benzoyl-7-hydroxy-3-O-propanoyl-14-oxopremyrsinol
gambogic acid
Gambogic Acid (Beta-Guttiferrin) is derived from the gamboges resin of the tree Garcinia hanburyi. Gambogic Acid (Beta-Guttiferrin) inhibits Bcl-XL, Bcl-2, Bcl-W, Bcl-B, Bfl-1 and Mcl-1 with IC50s of 1.47 μM, 1.21 μM, 2.02 μM, 0.66 μM, 1.06 μM and 0.79 μM. Gambogic Acid (Beta-Guttiferrin) is derived from the gamboges resin of the tree Garcinia hanburyi. Gambogic Acid (Beta-Guttiferrin) inhibits Bcl-XL, Bcl-2, Bcl-W, Bcl-B, Bfl-1 and Mcl-1 with IC50s of 1.47 μM, 1.21 μM, 2.02 μM, 0.66 μM, 1.06 μM and 0.79 μM.
Phe His Tyr Tyr
C33H36N6O7 (628.2645345999999)
Phe Asn Trp Tyr
C33H36N6O7 (628.2645345999999)
Phe Asn Tyr Trp
C33H36N6O7 (628.2645345999999)
Phe Trp Asn Tyr
C33H36N6O7 (628.2645345999999)
Phe Trp Tyr Asn
C33H36N6O7 (628.2645345999999)
Phe Tyr His Tyr
C33H36N6O7 (628.2645345999999)
Phe Tyr Asn Trp
C33H36N6O7 (628.2645345999999)
Phe Tyr Trp Asn
C33H36N6O7 (628.2645345999999)
Phe Tyr Tyr His
C33H36N6O7 (628.2645345999999)
His Phe Tyr Tyr
C33H36N6O7 (628.2645345999999)
His Met Arg Trp
His Met Trp Arg
His Arg Met Trp
His Arg Trp Met
His Thr Trp Trp
C32H36N8O6 (628.2757676000001)
His Trp Met Arg
His Trp Arg Met
His Trp Thr Trp
C32H36N8O6 (628.2757676000001)
His Trp Trp Thr
C32H36N8O6 (628.2757676000001)
His Tyr Phe Tyr
C33H36N6O7 (628.2645345999999)
His Tyr Tyr Phe
C33H36N6O7 (628.2645345999999)
Met His Arg Trp
Met His Trp Arg
Met Arg His Trp
Met Arg Trp His
Met Trp His Arg
Met Trp Arg His
Asn Phe Trp Tyr
C33H36N6O7 (628.2645345999999)
Asn Phe Tyr Trp
C33H36N6O7 (628.2645345999999)
Asn Trp Phe Tyr
C33H36N6O7 (628.2645345999999)
Asn Trp Tyr Phe
C33H36N6O7 (628.2645345999999)
Asn Tyr Phe Trp
C33H36N6O7 (628.2645345999999)
Asn Tyr Trp Phe
C33H36N6O7 (628.2645345999999)
Gln Arg Tyr Tyr
C29H40N8O8 (628.2968960000001)
Gln Tyr Arg Tyr
C29H40N8O8 (628.2968960000001)
Gln Tyr Tyr Arg
C29H40N8O8 (628.2968960000001)
Arg His Met Trp
Arg His Trp Met
Arg Met His Trp
Arg Met Trp His
Arg Gln Tyr Tyr
C29H40N8O8 (628.2968960000001)
Arg Trp His Met
Arg Trp Met His
Arg Tyr Gln Tyr
C29H40N8O8 (628.2968960000001)
Arg Tyr Tyr Gln
C29H40N8O8 (628.2968960000001)
Thr His Trp Trp
C32H36N8O6 (628.2757676000001)
Thr Trp His Trp
C32H36N8O6 (628.2757676000001)
Thr Trp Trp His
C32H36N8O6 (628.2757676000001)
Trp Phe Asn Tyr
C33H36N6O7 (628.2645345999999)
Trp Phe Tyr Asn
C33H36N6O7 (628.2645345999999)
Trp His Met Arg
Trp His Arg Met
Trp His Thr Trp
C32H36N8O6 (628.2757676000001)
Trp His Trp Thr
C32H36N8O6 (628.2757676000001)
Trp Met His Arg
Trp Met Arg His
Trp Asn Phe Tyr
C33H36N6O7 (628.2645345999999)
Trp Asn Tyr Phe
C33H36N6O7 (628.2645345999999)
Trp Arg His Met
Trp Arg Met His
Trp Thr His Trp
C32H36N8O6 (628.2757676000001)
Trp Thr Trp His
C32H36N8O6 (628.2757676000001)
Trp Trp His Thr
C32H36N8O6 (628.2757676000001)
Trp Trp Thr His
C32H36N8O6 (628.2757676000001)
Trp Tyr Phe Asn
C33H36N6O7 (628.2645345999999)
Trp Tyr Asn Phe
C33H36N6O7 (628.2645345999999)
Tyr Phe His Tyr
C33H36N6O7 (628.2645345999999)
Tyr Phe Asn Trp
C33H36N6O7 (628.2645345999999)
Tyr Phe Trp Asn
C33H36N6O7 (628.2645345999999)
Tyr Phe Tyr His
C33H36N6O7 (628.2645345999999)
Tyr His Phe Tyr
C33H36N6O7 (628.2645345999999)
Tyr His Tyr Phe
C33H36N6O7 (628.2645345999999)
Tyr Asn Phe Trp
C33H36N6O7 (628.2645345999999)
Tyr Asn Trp Phe
C33H36N6O7 (628.2645345999999)
Tyr Gln Arg Tyr
C29H40N8O8 (628.2968960000001)
Tyr Gln Tyr Arg
C29H40N8O8 (628.2968960000001)
Tyr Arg Gln Tyr
C29H40N8O8 (628.2968960000001)
Tyr Arg Tyr Gln
C29H40N8O8 (628.2968960000001)
Tyr Trp Phe Asn
C33H36N6O7 (628.2645345999999)
Tyr Trp Asn Phe
C33H36N6O7 (628.2645345999999)
Tyr Tyr Phe His
C33H36N6O7 (628.2645345999999)
Tyr Tyr His Phe
C33H36N6O7 (628.2645345999999)
Tyr Tyr Gln Arg
C29H40N8O8 (628.2968960000001)
Tyr Tyr Arg Gln
C29H40N8O8 (628.2968960000001)
Ca-FCC-2
β-Alanine, N-[[2-[[[4-[[[(hexyloxy)carbonyl]amino]carbonyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-, ethyl ester
C34H40N6O6 (628.3009180000001)
9,9-Dimethyl-2,7-bis[N-(1-naphthyl)-N-phenylamino]fluorene
Levalbuterol tartrate
C30H48N2O12 (628.3207087999999)
C78273 - Agent Affecting Respiratory System > C29712 - Anti-asthmatic Agent > C319 - Bronchodilator C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist
4-Butyl-N-[(11bR)-dinaphtho[2,1-d:1,2-f][1,3,2]dioxaphosphepin-4-yl]benzenesulfonamide triethylamine adduct
Orvepitant
C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
3-[(2Z,3S,4S)-5-[(4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-2-[2-[(3-ethyl-5-formyl-4-methyl-1H-pyrrol-2-yl)methyl]-4-hydroxy-5-methoxycarbonyl-3-methyl-1H-cyclopenta[b]pyrrol-6-ylidene]-4-methyl-3,4-dihydropyrrol-3-yl]propanoic acid
Ajugaciliatin B
A diterpene lactone isolated from the whole plants of Ajuga ciliata and has been shown to exhibit neuroprotective activity.
Ajugaciliatin D
A diterpene lactone isolated from the whole plants of Ajuga ciliata.
sodium;(2S)-2-[[(2S)-2-[[4-ethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]oxycarbonylamino]-4-methylpentanoyl]amino]-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonate
1-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-methoxyphenyl)urea
1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-methoxyphenyl)urea
(3S)-2-tert-butylsulfinyl-3-(2-hydroxyethyl)-4-[3-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-N-[(3R)-1-(phenylmethyl)-3-pyrrolidinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxamide
[(3R)-2-tert-butylsulfinyl-3-(2-hydroxyethyl)-4-[3-(3-hydroxy-3-methylbut-1-ynyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl]-[4-(phenylmethyl)-1-piperazinyl]methanone
3-[(3S,4S)-2-[(4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl)methyl]-5-[2-[(3-ethyl-5-formyl-4-methyl-1H-pyrrol-2-yl)methyl]-5-methoxycarbonyl-3-methyl-4-oxo-1H-cyclopenta[b]pyrrol-6-yl]-3-methyl-3,4-dihydro-2H-pyrrol-4-yl]propanoic acid
[1-[Hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-propanoyloxypropan-2-yl] hexadecanoate
[1-Hexanoyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] tridecanoate
[1-Heptanoyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] dodecanoate
[1-[Hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-nonanoyloxypropan-2-yl] decanoate
[1-[Hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-pentanoyloxypropan-2-yl] tetradecanoate
[1-Butanoyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] pentadecanoate
[1-[Hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-octanoyloxypropan-2-yl] undecanoate
[1-Acetyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] heptadecanoate
[2-[(5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoyl]oxy-3-phosphonooxypropyl] (5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoate
primary fluorescent chlorophyll catabolite
A member of the class of bilenes that is red chlorophyll catabolite in which a methylene group is introduced at position 1 via the reduction of a double bond. It is an intermediate of chlorophyll breakdown in plants.
Capsicum annuum Fluorescent chlorophyll catabolite
(2z)-4-[(1s,2s,9r,14r,21s,23r)-16-hydroxy-8,8,12,25,25-pentamethyl-5-(3-methylbut-2-en-1-yl)-18,22-dioxo-3,7,24-trioxaheptacyclo[19.4.1.0²,¹⁹.0²,²³.0⁴,¹⁷.0⁶,¹⁵.0⁹,¹⁴]hexacosa-4,6(15),12,16,19-pentaen-23-yl]-2-methylbut-2-enoic acid
(1r,2r,4s,5s,6s,10r,11s,15r,16r,18s,19r)-4,18-bis(acetyloxy)-16-hydroxy-1,5,10,15-tetramethyl-6-(5-oxooxolan-3-yl)-13-oxapentacyclo[10.6.1.0²,¹⁰.0⁵,⁹.0¹⁵,¹⁹]nonadec-8-en-11-yl (2e)-2-methylbut-2-enoate
(2e)-4-[(2s,8r,19s)-14-hydroxy-8,23,23-trimethyl-5-(3-methylbut-2-en-1-yl)-16,20-dioxo-11-(prop-1-en-2-yl)-3,7,22-trioxaheptacyclo[17.4.1.1⁸,¹².0²,¹⁷.0²,²¹.0⁴,¹⁵.0⁶,¹³]pentacosa-4(15),5,13,17-tetraen-21-yl]-2-methylbut-2-enoic acid
4-[12-hydroxy-8,8,21,21-tetramethyl-5,17-bis(3-methylbut-2-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid
(2e)-4-[(1s,2s,8r,17s,19r)-12-hydroxy-8,21,21-trimethyl-5-(3-methylbut-2-en-1-yl)-8-(4-methylpent-3-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid
(1r,2s,4r,6r,9r,10r,11r,12s,14r,15r,18r)-14-(acetyloxy)-6-(5-hydroxy-2-oxo-5h-furan-3-yl)-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.0²,⁹.0⁴,⁸.0¹⁵,¹⁸]octadec-7-en-12-yl (2e)-2-methylbut-2-enoate
[(1r,2r,6r,10s,11r,15r,17r)-13-benzyl-6-hydroxy-4,17-dimethyl-5-oxo-15-(prop-1-en-2-yl)-12,14,18-trioxapentacyclo[11.4.1.0¹,¹⁰.0²,⁶.0¹¹,¹⁵]octadeca-3,8-dien-8-yl]methyl 2-(4-hydroxy-3-methoxyphenyl)acetate
(2z)-4-[(1r,2r,17r,19s)-12-hydroxy-8,8,21,21-tetramethyl-5,17-bis(3-methylbut-2-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid
(4s,4as,6s,7r,7as)-4-(methoxycarbonyl)-7-methyl-3-oxo-hexahydro-1h-cyclopenta[c]pyran-6-yl (4s,5s,6s)-4-[2-(acetyloxy)ethyl]-5-ethenyl-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6-dihydro-4h-pyran-3-carboxylate
4,12,18,19-tetrahydroxy-13-[(6-hydroxy-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl)methyl]-6-methylpentacyclo[8.7.4.0¹,¹⁰.0³,⁸.0¹¹,¹⁶]henicosa-3,5,7,11(16),12,20-hexaene-2,9,14,15-tetrone
(1r,2s,4s,6r,9r,10r,11r,12s,14r,15r,18r)-14-(acetyloxy)-6-[(5s)-5-hydroxy-2-oxo-5h-furan-3-yl]-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.0²,⁹.0⁴,⁸.0¹⁵,¹⁸]octadec-7-en-12-yl (2e)-2-methylbut-2-enoate
(1r,2r,4r,6s,8s,11r,12s,13r,16r,17r,19s,20r)-17-(acetyloxy)-4-ethoxy-19-hydroxy-1,9,11,16-tetramethyl-8-(2-oxo-5h-furan-3-yl)-5,14-dioxapentacyclo[11.6.1.0²,¹¹.0⁶,¹⁰.0¹⁶,²⁰]icos-9-en-12-yl (2e)-2-methylbut-2-enoate
n-[(2s)-1-[(1r,12r,13s,14r)-1-hydroxy-3-methoxy-12-(4-methoxyphenyl)-15-oxo-13-phenyl-5,7,11-trioxatetracyclo[10.2.1.0²,¹⁰.0⁴,⁸]pentadeca-2,4(8),9-triene-14-carbonyl]pyrrolidin-2-yl]-2-methylpropanimidic acid
6,7-dihydroxy-8-(hydroxymethyl)-4,18-dimethyl-5-oxo-14-phenyl-16-(prop-1-en-2-yl)-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-17-yl 3-phenylprop-2-enoate
(1s,2s,3r,4r,7r,8s,10z,12s,13r,14s,16r,17s)-2,12,14-tris(acetyloxy)-8-chloro-3,17-dihydroxy-4,13,17-trimethyl-9-methylidene-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadec-10-en-16-yl butanoate
C30H41ClO12 (628.2286416000001)
5-(acetyloxy)-3-(2-hydroxy-5-oxo-2h-furan-3-yl)-6-[6-(2-methoxy-2-oxoethyl)-1,5,5-trimethyl-4-oxocyclohex-2-en-1-yl]-3a-methyl-7-methylidene-hexahydroindeno[1,7a-b]oxiren-4-yl 2-methylbutanoate
(4s,6s,7r)-4-(methoxycarbonyl)-7-methyl-3-oxo-hexahydro-1h-cyclopenta[c]pyran-6-yl (4s,6s)-4-[2-(acetyloxy)ethyl]-5-ethenyl-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6-dihydro-4h-pyran-3-carboxylate
2-(acetyloxy)-12,15-dihydroxy-9-(4-hydroxyphenyl)-17-(2-hydroxypropan-2-yl)-14,19-dimethyl-4,8,10-trioxapentacyclo[9.7.1.0²,⁵.0⁷,¹⁹.0¹³,¹⁷]nonadec-13-en-18-yl 2-methylbut-2-enoate
(1r,2r,4s,5s,6s,10r,11s,12r,15r,16r,18s,19r)-4,18-bis(acetyloxy)-16-hydroxy-1,5,10,15-tetramethyl-6-[(3r)-5-oxooxolan-3-yl]-13-oxapentacyclo[10.6.1.0²,¹⁰.0⁵,⁹.0¹⁵,¹⁹]nonadec-8-en-11-yl (2e)-2-methylbut-2-enoate
4-(methoxycarbonyl)-7-methyl-3-oxo-hexahydro-1h-cyclopenta[c]pyran-6-yl 4-[2-(acetyloxy)ethyl]-5-ethenyl-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6-dihydro-4h-pyran-3-carboxylate
1β,2β,3α,5α,7β,8β,11-heptaacetoxy-dihydro-agarofuran
{"Ingredient_id": "HBIN002348","Ingredient_name": "1\u03b2,2\u03b2,3\u03b1,5\u03b1,7\u03b2,8\u03b2,11-heptaacetoxy-dihydro-agarofuran","Alias": "NA","Ingredient_formula": "C29H40O15","Ingredient_Smile": "CC1C(C(C(C2(C13C(C(C(C2OC(=O)C)OC(=O)C)C(O3)(C)C)OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15716","TCMID_id": "9366","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
allogambogic acid
{"Ingredient_id": "HBIN015220","Ingredient_name": "allogambogic acid","Alias": "NA","Ingredient_formula": "C38H44O8","Ingredient_Smile": "CC(=CCCC1(C=CC2=C(C(=C3C(=C2O1)C(=O)C4=CC5CC6C4(O3)C(C5=O)(OC6(C)C)CC=C(C)C(=O)O)CC=C(C)C)O)C)C","Ingredient_weight": "628.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "23602","TCMSP_id": "NA","TCM_ID_id": "7006","PubChem_id": "6444544","DrugBank_id": "NA"}
(2e)-4-[(8s)-12-hydroxy-8,21,21-trimethyl-5-(3-methylbut-2-en-1-yl)-8-(4-methylpent-3-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid
(2z)-4-[(1s,2s,8s,11s,12s,19s,21r)-14-hydroxy-8,23,23-trimethyl-5-(3-methylbut-2-en-1-yl)-16,20-dioxo-11-(prop-1-en-2-yl)-3,7,22-trioxaheptacyclo[17.4.1.1⁸,¹².0²,¹⁷.0²,²¹.0⁴,¹⁵.0⁶,¹³]pentacosa-4(15),5,13,17-tetraen-21-yl]-2-methylbut-2-enoic acid
(1s,2s,4s,6r,8s,11s,12r,13s,16s,17s,19r,20s)-17-(acetyloxy)-4-ethoxy-19-hydroxy-1,9,11,16-tetramethyl-8-(2-oxo-5h-furan-3-yl)-5,14-dioxapentacyclo[11.6.1.0²,¹¹.0⁶,¹⁰.0¹⁶,²⁰]icos-9-en-12-yl (2e)-2-methylbut-2-enoate
(1s,2r,4r,5r,6s,8r,10s,11s,12r,14r,15r,16r,19s,21r)-21-(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-16-(2-methylpropanoyl)-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-4-yl acetate
n-(4-carbamimidamidobutyl)-1-(2-{[3-(3,5-dichloro-4-hydroxyphenyl)-1,2-dihydroxypropylidene]amino}-3-methylbutanoyl)-6-hydroxy-octahydroindole-2-carboximidic acid
(1r,2r,4r,6s,8r,11r,12s,13r,16r,17r,19s,20r)-17-(acetyloxy)-4-ethoxy-19-hydroxy-1,9,11,16-tetramethyl-8-(2-oxo-5h-furan-3-yl)-5,14-dioxapentacyclo[11.6.1.0²,¹¹.0⁶,¹⁰.0¹⁶,²⁰]icos-9-en-12-yl (2e)-2-methylbut-2-enoate
n-[(2r)-1-[(10r,12r,13s,14r)-10-hydroxy-8-methoxy-14-(4-methoxyphenyl)-11-oxo-13-phenyl-4,6,15-trioxatetracyclo[7.6.0.0³,⁷.0¹⁰,¹⁴]pentadeca-1,3(7),8-triene-12-carbonyl]pyrrolidin-2-yl]-2-methylpropanimidic acid
n-{2-[({7-[(acetyloxy)methyl]-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl}oxy)carbonyl]phenyl}-2-aminobenzenecarboximidic acid
n-[(2s)-1-[(1r,12r,13r,14s)-1-hydroxy-3-methoxy-12-(4-methoxyphenyl)-15-oxo-13-phenyl-5,7,11-trioxatetracyclo[10.2.1.0²,¹⁰.0⁴,⁸]pentadeca-2,4(8),9-triene-14-carbonyl]pyrrolidin-2-yl]-2-methylpropanimidic acid
(1r,2r,4r,6s,8s,11r,12s,13r,16r,17r,19s,20r)-17-(acetyloxy)-4-ethoxy-19-hydroxy-1,9,11,16-tetramethyl-8-[(3r)-2-oxo-3h-furan-3-yl]-5,14-dioxapentacyclo[11.6.1.0²,¹¹.0⁶,¹⁰.0¹⁶,²⁰]icos-9-en-12-yl (2e)-2-methylbut-2-enoate
4-[16-hydroxy-8,8,12,25,25-pentamethyl-5-(3-methylbut-2-en-1-yl)-18,22-dioxo-3,7,24-trioxaheptacyclo[19.4.1.0²,¹⁹.0²,²³.0⁴,¹⁷.0⁶,¹⁵.0⁹,¹⁴]hexacosa-4,6(15),12,16,19-pentaen-23-yl]-2-methylbut-2-enoic acid
n-[2-({[(1s,4s,5r,6r,9s,10r,12r,14r)-7-[(acetyloxy)methyl]-4,5-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-6-yl]oxy}carbonyl)phenyl]-2-aminobenzenecarboximidic acid
1-hydroxy-4-(methoxycarbonyl)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-6-yl 4-[2-(acetyloxy)ethyl]-5-ethenyl-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6-dihydro-4h-pyran-3-carboxylate
4-[(1r,2s,8r,17s,19r)-12-hydroxy-8,21,21-trimethyl-5-(3-methylbut-2-en-1-yl)-8-(4-methylpent-3-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid
18-(acetyloxy)-6-(furan-3-yl)-16-hydroxy-12-(2-methoxy-2-oxoethyl)-7,11,13,13-tetramethyl-4-oxo-5,17-dioxapentacyclo[13.2.1.0¹,¹⁰.0²,⁷.0¹¹,¹⁶]octadec-2-en-14-yl 2-methylbutanoate
(1s,6s,7s,10s,11r,12r,14s,15s,16r,18s)-18-(acetyloxy)-6-(furan-3-yl)-16-hydroxy-12-(2-methoxy-2-oxoethyl)-7,11,13,13-tetramethyl-4-oxo-5,17-dioxapentacyclo[13.2.1.0¹,¹⁰.0²,⁷.0¹¹,¹⁶]octadec-2-en-14-yl (2r)-2-methylbutanoate
n-[2-({[4-(acetyloxy)-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-7-yl]methoxy}carbonyl)phenyl]-2-aminobenzenecarboximidic acid
methyl 2-[(1s,2s,3r,5r,6r,10s,13r,14s,16s)-3,13,14-tris(acetyloxy)-6-(furan-3-yl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.0²,¹¹.0⁵,¹⁰]heptadec-11-en-16-yl]acetate
(1r,2s,5r,7s,9s,11r,12r,15s,17s,18s,19s)-2-(acetyloxy)-12,15-dihydroxy-9-(4-hydroxyphenyl)-17-(2-hydroxypropan-2-yl)-14,19-dimethyl-4,8,10-trioxapentacyclo[9.7.1.0²,⁵.0⁷,¹⁹.0¹³,¹⁷]nonadec-13-en-18-yl (2e)-2-methylbut-2-enoate
(1r,2r,6s,7s,8r,10s,11s,12r,14s,16s,17r,18r)-6,7-dihydroxy-8-(hydroxymethyl)-4,18-dimethyl-5-oxo-14-phenyl-16-(prop-1-en-2-yl)-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-17-yl (2e)-3-phenylprop-2-enoate
[13-benzyl-6-hydroxy-4,17-dimethyl-5-oxo-15-(prop-1-en-2-yl)-12,14,18-trioxapentacyclo[11.4.1.0¹,¹⁰.0²,⁶.0¹¹,¹⁵]octadeca-3,8-dien-8-yl]methyl 2-(3-hydroxy-5-methoxyphenyl)acetate
4-[12-hydroxy-8,21,21-trimethyl-5-(3-methylbut-2-en-1-yl)-8-(4-methylpent-3-en-1-yl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.0²,¹⁵.0²,¹⁹.0⁴,¹³.0⁶,¹¹]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid
14-(acetyloxy)-6-(5-hydroxy-2-oxo-5h-furan-3-yl)-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.0²,⁹.0⁴,⁸.0¹⁵,¹⁸]octadec-7-en-12-yl (2e)-2-methylbut-2-enoate
(1r,2s,4r,6r,9r,10r,11r,12s,14r,15r,18r)-14-(acetyloxy)-6-(2-hydroxy-5-oxo-2h-furan-3-yl)-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.0²,⁹.0⁴,⁸.0¹⁵,¹⁸]octadec-7-en-12-yl (2e)-2-methylbut-2-enoate
2',14',16'-tris(acetyloxy)-8'-chloro-3'-hydroxy-4',13'-dimethyl-9'-methylidene-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0³,⁷]heptadecan]-12'-yl 2-methylpropanoate
C30H41ClO12 (628.2286416000001)
n-{1-[1-hydroxy-3-methoxy-12-(4-methoxyphenyl)-15-oxo-13-phenyl-5,7,11-trioxatetracyclo[10.2.1.0²,¹⁰.0⁴,⁸]pentadeca-2,4(8),9-triene-14-carbonyl]pyrrolidin-2-yl}-2-methylpropanimidic acid
(1r,4as,6s,7r,7as)-1-hydroxy-4-(methoxycarbonyl)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-6-yl (4s,5s,6s)-4-[2-(acetyloxy)ethyl]-5-ethenyl-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6-dihydro-4h-pyran-3-carboxylate
n-[2-({[(4s,5s,6r,9r,10r,12r,14r)-7-[(acetyloxy)methyl]-4,5-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-6-yl]oxy}carbonyl)phenyl]-2-aminobenzenecarboximidic acid
[(1r,2r,6r,11r,13s,15s,17r)-13-benzyl-6-hydroxy-4,17-dimethyl-5-oxo-15-(prop-1-en-2-yl)-12,14,18-trioxapentacyclo[11.4.1.0¹,¹⁰.0²,⁶.0¹¹,¹⁵]octadeca-3,8-dien-8-yl]methyl 2-(4-hydroxy-3-methoxyphenyl)acetate
(2e)-n-[(2s)-1-[(1r,9r,10s,11r,12s)-1,12-dihydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-10-phenyl-8-oxatricyclo[7.2.1.0²,⁷]dodeca-2,4,6-triene-11-carbonyl]pyrrolidin-2-yl]-2-methylbut-2-enimidic acid
(2s,3as,6r,7as)-n-(4-carbamimidamidobutyl)-1-[(2r)-2-{[(2r)-3-(3,5-dichloro-4-hydroxyphenyl)-1,2-dihydroxypropylidene]amino}-3-methylbutanoyl]-6-hydroxy-octahydroindole-2-carboximidic acid
2-{2-[(1r,2s,5s)-10,14-dihydroxy-5-(methoxycarbonyl)-2-(prop-1-en-2-yl)-6,18-dioxapentacyclo[9.7.1.1¹,⁵.0⁷,¹⁹.0¹²,¹⁷]icosa-7(19),8,10,12,14,16-hexaen-16-yl]ethylidene}-6,10-dimethylundeca-5,9-dienoic acid
(1r,2s,4r,6r,9r,10r,11r,12s,14r,15r,18r)-14-(acetyloxy)-6-[(5s)-5-hydroxy-2-oxo-5h-furan-3-yl]-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.0²,⁹.0⁴,⁸.0¹⁵,¹⁸]octadec-7-en-12-yl (2e)-2-methylbut-2-enoate
n-[2-({[(1s,4s,5s,6r,9r,10r,12r,14r)-7-[(acetyloxy)methyl]-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl]oxy}carbonyl)phenyl]-2-aminobenzenecarboximidic acid
n-{2-[({7-[(acetyloxy)methyl]-4,5-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-6-yl}oxy)carbonyl]phenyl}-2-aminobenzenecarboximidic acid
(1's,2r,2's,3'r,4'r,7'r,8's,12's,13's,14's,16'r)-2',14',16'-tris(acetyloxy)-8'-chloro-3'-hydroxy-4',13'-dimethyl-9'-methylidene-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0³,⁷]heptadecan]-12'-yl 2-methylpropanoate
C30H41ClO12 (628.2286416000001)