Exact Mass: 336.1507554
Exact Mass Matches: 336.1507554
Found 500 metabolites which its exact mass value is equals to given mass value 336.1507554
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
CYCLOPIAZONIC ACID
D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D004791 - Enzyme Inhibitors Cyclopiazonic acid (CPA), a neurotoxic secondary metabolite (SM) made by Aspergillus flavus, is an inhibitor of endoplasmic reticulum calcium ATPase (Ca2+ATPase; SERCA) and a potent inducer of cell death in plants[1].
Nb-Feruloyltryptamine
Nb-Feruloyltryptamine is found in cereals and cereal products. Nb-Feruloyltryptamine is found in kernels of sweet corn (Zea mays). Found in kernels of sweet corn (Zea mays)
Licoagrochalcone B
Licoagrochalcone B is found in herbs and spices. Licoagrochalcone B is isolated from hairy root cultures of Glycyrrhiza glabra (licorice Isolated from hairy root cultures of Glycyrrhiza glabra (licorice). Licoagrochalcone B is found in tea and herbs and spices.
N2-Fructopyranosylarginine
N2-Fructopyranosylarginine is found in tea. N2-Fructopyranosylarginine is a constituent of Korean red ginseng. Constituent of Korean red ginseng. N2-Fructopyranosylarginine is found in tea.
Semilepidinoside A
Semilepidinoside A is found in brassicas. Semilepidinoside A is an alkaloid from the seeds of Lepidium sativum (garden cress). Alkaloid from the seeds of Lepidium sativum (garden cress). Semilepidinoside A is found in garden cress and brassicas.
Curcumin III
Curcumin III is found in herbs and spices. Curcumin III is isolated from the rhizomes of Curcuma longa (turmeric). Isolated from the rhizomes of Curcuma longa (turmeric). Curcumin III is found in herbs and spices.
2-Propenamide, 2-cyano-3-(3,4-dihydroxyphenyl)-N-(4-phenylbutyl)-
Agar
2-Propanamine, N,N,2-trimethyl-1-((3-phenyl-2-quinolinyl)thio)-
1,1'-(1,8-Dioxo-1,8-octanediyl)bis-2,5-pyrrolidinedione
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D003432 - Cross-Linking Reagents
(2R,3S,9R)-5-Acetyl-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.02,9.03,7.015,18]octadeca-1(17),11(18),12,14-tetraene-4,6-dione
Hemileiocarpin
Isobutyric acid [3-[3-methoxy-4-(isobutyryloxy)phenyl]oxiranyl]methyl ester
γ-Linolenoyl-CoA
CONFIDENCE isolated standard Cyclopiazonic acid (CPA), a neurotoxic secondary metabolite (SM) made by Aspergillus flavus, is an inhibitor of endoplasmic reticulum calcium ATPase (Ca2+ATPase; SERCA) and a potent inducer of cell death in plants[1].
cedreprenone
2,4-Dihydroxy-3,6,6-trimethylpyrano[2,3:6,5]chalcone
Lanceolatin A(flavonoid)
(Z)-3-hydroxy-1-(5-methoxy-2,2-dimethyl-2H-chromen-6-yl)-3-phenylprop-2-en-1-one|purpurenone
2,3-Dihydro-5-hydroxy-8,8,10-trimethyl-2-phenyl-4H,8H-benzo[1,2-b:5,4-b]dipyran-4-one
Me ester,Ac -(1(10)E,4alpha,6alpha)-15-Hydroxy-1(10),11(13)-germacradien-12,6-olid-14-oic acid|Methyl 15-acetoxy-4betaH-germacra-1(10)E,11(13)-trien-6alpha,12-olide-14-oic acid
8-acetoxy-2-methoxy-10-hydroxy-3,11(13)-guaiadien-12,6-olide
(3S,6Z)-3-benzyl-6-(4-methoxybenzylidene)-1-methylpyrazine-2,5-dione|nocazine C
1-(7-Hydroxy-5-methoxy-2,2-dimethyl-2H-chromen-6-yl)-3t(?)-phenyl-propenon|1-(7-hydroxy-5-methoxy-2,2-dimethyl-2H-chromen-6-yl)-3t(?)-phenyl-propenone|Oaxacacin
3beta-(acetyloxy)-11-methoxy-8-oxoeremophila-6,9-dien-12-oic acid|7-(acetyloxy)-3,5,6,7,8,8a-hexahydro-alpha-methoxy-alpha,8,8a-trimethyl-3-oxo-2-naphthaleneacetic acid
17-Epinaucleidinal|19-epi-naucleidinal|epi-19 naucleidinal|naucleidinal
5-hydroxy-7-methoxy-8-(3-methylbut-2-enyl)-2-phenyl-chromen-4-one
(1S,2R,5R,6S,7R,8S,10R)-6-acetoxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide
A pseudoguaianolide with anti-inflammatory activity isolated from the aerial parts of Inula hupehensis.
7-Hydroxy-5-methoxy-8-(3-methyl-2-butenyl)-4-phenyl-2H-1-benzopyran-2-one
eudesm-4(15),11(13)-dien-1beta-hydroxy-6alpha-acetoxyl-7alpha,8alpha-epoxy-12-carboxylic acid methyl ester|jatrophaeudesmene C
3-[N-benzamide]-N-phenylethyl-glutarimide|crotonimide C
(E)-2-methyl-4-((E)-3-phenylprop-2-enoyloxy)-but-2-enyl benzoate|uvaridacane B
1-acetoxy-2-methoxy-4-(3-methyl-5-propenyl-benzofuran-2-yl)-benzene
(E)-3-(3,5-dimethoxy-4-(2R-methylbutyryloxy)phenyl)prop-2-enol acetate|dichrocephol C
2-(1-Methylvinyl)-4-hydroxy-7-(4-hydroxyphenyl)-2,3,5,6,7,8-hexahydronaphtho[2,3-b]furan-5-one
1-hydroxymethylphenyl 4-hydroxy-3-(4-hydroxybenzyl) benzyl ether|gastrol B
eudesm-3,11(13)-dien-1beta-hydroxy-6alpha-acetoxyl-7alpha,8alpha-epoxy-12-carboxylic acid methyl ester|jatrophaeudesmene B
2-hydroxy-6-methoxy-6,6-dimethylchromeno(4,3:2,3)chalcone|obovatachalcone|Pongachalcone I
8alpha-acetoxy-4alpha-hydroxy-10alpha-methoxy-guai-6,7,11(13)-diene-6,12-olide
5-Deoxy-3-C-hydroxymethyllyxose,9CI-Benzyl glycoside, 3,3-O-isopropylidene, 2-O-Ac
(4S,4aR,5R,6S,9aR)-6-(acetyloxy)-4a,5,6,7,8,9a-hexahydro-9a-hydroxy-4-methoxy-3,4a,5-trimethylnaphtho[2,3-b]furan-2(4H)-one|3beta-acetoxy-8alpha-hydroxy-6beta-methoxyeremophila-7(11),9(10)-dien-12,8beta-olide
3-[6-(4-Hydroxyphenethyl)-2-hydroxyphenoxy]benzyl alcohol
11-Me ether-2,2,12-Trimethyl-2H-naphtho[1,2-f][1]benzopyran-8,9,11-triol|11-Methoxy-2,2,12-trimethyl-2H-naphtho<1,2-f><1>benzopyran-8,9-diol|11-Methoxy-2,2,12-trimethyl-2H-naphtho[1,2-f][1]benzopyran-8,9-diol
2,4-Diamino-2,4,6-trideoxygalactose-Benzyl glycoside, di-N-Ac
(2S,3S)-3,6-dihydro-6-oxo-2-{(1E)-2-[(4S,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl]ethenyl}-2H-pyran-3-yl (2E)-2-methylbut-2-enoate|(5S,6S,3S,4S,1E,2E)-5,6-dihydro-6-(3,4-isopropylidenedioxy-1-pentenyl)-5-(2-methyl-2-butenoyloxy)-2H-pyran-2-one|(E)-(2S,3S)-6-oxo-2-((E)-2-((4S,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl)vinyl)-3,6-dihydro-2H-pyran-3-yl 2-methylbut-2-enoate
4-[[4-[[4-(Hydroxymethyl)phenoxy]methyl]phenoxy]methyl]phenol
2,6-Diamino-2,3,4,6-tetradeoxy-erythro-hexose,9CI,8CI-Di-Et-dithioacetal, 2,6-di-N-Ac
C14H28N2O3S2 (336.15412580000003)
(E)-1-(5-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3-(4-methoxyphenyl)prop-2-en-1-one|1-(5-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3-(4-methoxyphenyl)-propenone|4-Methoxylonchocarpin
Rengynic acid 1-O-??-D-glucoside|rengynic acid-10-O-beta-D-glucopyranoside
3-Ethoxy-4-(hydroxymethyl)-7-methoxy-6-methyl-5-<(3-methyl-2-butenyl)oxy>-1(3H)-isobenzofuranon|3-Ethoxy-4-(hydroxymethyl)-7-methoxy-6-methyl-5-[(3-methyl-2-butenyl)oxy]-1(3H)-isobenzofuranon|O5-(3-Methyl-2-butenyl)-3-Ethoxy-5-hydroxy-4-(hydroxymethy1)-7-methoxy-6-methy1-1(3H)-isobenzofuranone
Danshenol A
Danshenol A is a natural product found in Salvia miltiorrhiza and Salvia glutinosa with data available.
8-(3-ethoxy-2-hydroxy-3-methylbutyl)-5,7-dimethoxycoumarin
8-(3-Ethoxy-2-hydroxy-3-methylbutyl)-5,7-dimethoxycoumarin is a natural product found in Murraya alata with data available.
(E)-1-(5,7-dihydroxy-2,2,6-trimethylchromen-8-yl)-3-phenylprop-2-en-1-one
(2R)-5-methoxy-8,8-dimethyl-2-phenyl-2,3-dihydropyrano[2,3-h]chromen-4-one
9-methoxy-4,4-dimethyl-13-phenyl-6,14-dioxatetracyclo[8.4.0.0²,⁷.0³,⁵]tetradeca-1,7,9-trien-11-one
(2R)-5-methoxy-8,8-dimethyl-2-phenyl-2,3-dihydropyrano[2,3-h]chromen-4-one
Butylphthalyl butylglycolate
CONFIDENCE standard compound; INTERNAL_ID 668; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9834; ORIGINAL_PRECURSOR_SCAN_NO 9831 CONFIDENCE standard compound; INTERNAL_ID 668; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9872; ORIGINAL_PRECURSOR_SCAN_NO 9867 CONFIDENCE standard compound; INTERNAL_ID 668; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9889; ORIGINAL_PRECURSOR_SCAN_NO 9887 CONFIDENCE standard compound; INTERNAL_ID 668; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9939; ORIGINAL_PRECURSOR_SCAN_NO 9936 CONFIDENCE standard compound; INTERNAL_ID 668; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9940; ORIGINAL_PRECURSOR_SCAN_NO 9937 CONFIDENCE standard compound; INTERNAL_ID 668; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9948; ORIGINAL_PRECURSOR_SCAN_NO 9945
9-methoxy-4,4-dimethyl-13-phenyl-6,14-dioxatetracyclo[8.4.0.0²,?.0³,?]tetradeca-1,7,9-trien-11-one
YM-53601
Maracen A
C19H25O3Cl (336.14921300000003)
N-[[(5S)-3-(3-fluoro-4-piperazin-1-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
C16H21FN4O3 (336.15976079999996)
6-(1-((TERT-BUTYLDIMETHYLSILYL)OXY)-2-NITROPROPYL)-[1,2,4]TRIAZOLO[1,5-A]PYRIDINE
1-benzhydryl-3-trimethylsilyloxy-azetidine-3-carbonitrile
C20H24N2OSi (336.16578139999996)
2-Methyl-2-propanyl 3-(7-chloropyrazolo[1,5-a]pyrimidin-5-yl)-1-p iperidinecarboxylate
tert-butyl 4-(2-methyl-4-nitrophenoxy)piperidine-1-carboxylate
N-[[3-(3-Fluoro-4-(piperazin-1-yl)phenyl)-2-oxooxazolidin-5-yl]methyl]acetamide
C16H21FN4O3 (336.15976079999996)
4-(BENZYLOXY)-5-METHOXY-7-(METHOXYMETHYL)-1-NAPHTHALDEHYDE
5-FLUORO-4-IODO-1-(TRIISOPROPYLSILYL)-1H-PYRROLO[2,3-B]PYRIDINE
tert-butyl 5-amino-5-oxo-4-(phenylmethoxycarbonylamino)pentanoate
1H-PYRROLO[2,3-B]PYRIDINE-5-CARBOXALDEHYDE, 4-CHLORO-1-[TRIS(1-METHYLETHYL)SILYL]-
4-(Aminocarbonyl)-N-[(1,1-dimethylethoxy)carbonyl]-2,6-dimethyl-L-phenylalanine
tert-butyl 1-[[(4-nitrophenoxy)carbonylamino]methyl]cyclopropane-1-carboxylate
(3R,4S)-1-(tert-Butoxycarbonyl)-4-(3-nitrophenyl)pyrrolidine-3-carboxylic acid
(3R,4S)-1-(TERT-BUTOXYCARBONYL)-4-(2-NITROPHENYL)PYRROLIDINE-3-CARBOXYLIC ACID
(3R,4S)-1-(TERT-BUTOXYCARBONYL)-4-(4-NITROPHENYL)PYRROLIDINE-3-CARBOXYLIC ACID
N-(4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL)BENZO[D]OXAZOL-2-AMINE
C19H21BN2O3 (336.16451459999996)
N,N-(Methylenedi-p-phenylene)bis(aziridine-1-carboxamide)
Plinabulin
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D054659 - Diketopiperazines
(3-glycidoxypropyl)bis(trimethylsiloxy)methylsilane
methyl 4-(2-((tert-butoxycarbonyl)amino)ethyl)thiomorpholine-3-carboxylate 1,1-dioxide
benzyl 5-amino-4-[(tert-butoxycarbonyl)amino]-5-oxopentanoate
1-BOC-6-FLUORO-1,2-DIHYDRO-2-OXOSPIRO[4H-3,1-BENZOXAZINE-4,4-PIPERIDINE]
Cc-115
C16H16N8O (336.14470059999996)
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C192218 - DNA-dependent Protein Kinase Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2201 - mTOR Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor CC-115 is a potent and dual DNA-PK and mTOR kinase inhibitor with IC50s of 13 nM and 21 nM, respectively. CC-115 blocks both mTORC1 and mTORC2 signaling. CC-115 is a potent and dual DNA-PK and mTOR kinase inhibitor with IC50s of 13 nM and 21 nM, respectively. CC-115 blocks both mTORC1 and mTORC2 signaling.
4-({4-[(4-Methoxypyridin-2-Yl)amino]piperidin-1-Yl}carbonyl)benzonitrile
5-[[4-Methoxy-3-(phenylmethoxy)phenyl]methyl]-2,4-pyrimidinediamine
[5-Fluoro-1-(4-isopropylbenzylidene)-2-methylinden-3-yl]acetic acid
K-80003 is a potent inhibitor of tRXRα-dependent Akt activation and cancer cell growth.
2-(1,3-Benzoxazol-2-ylamino)-5-spiro[1,6,7,8-tetrahydroquinazoline-4,1-cyclopentane]one
(1S,2S,5R,6S,7R,8S,10R)-6-acetoxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide
A pseudoguaianolide with anti-inflammatory activity isolated from the aerial parts of Inula hupehensis.
6-[4-(4-Methoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-3-(2-methylprop-2-enoxy)-1-cyclohexa-2,4-dienone
2-{(E)-[2-(4,6-dimethylpyrimidin-2-yl)hydrazinylidene]methyl}-3-hydroxy-5-phenylcyclohex-2-en-1-one
8-(2-methylphenoxy)-2-(4-morpholinyl)-1H-quinolin-4-one
2-[1-(2,6-Dioxocyclohexyl)-3-phenylprop-2-ynyl]cyclohexane-1,3-dione
N-(3-Chlorobenzyl)-1-(4-Methylpentanoyl)-L-Prolinamide
(6aR,10Z,11aS,11bR)-10-(1-hydroxyethylidene)-7,7-dimethyl-6a,7,11a,11b-tetrahydro-6H-pyrrolo[1,2:2,3]isoindolo[4,5,6-cd]indole-9,11(2H,10H)-dione
2-{5-[Amino(iminio)methyl]-1H-benzimidazol-2-YL}-6-(cyclopentyloxy)benzenolate
9-Methoxy-4,4-dimethyl-13-phenyl-6,14-dioxatetracyclo[8.4.0.02,7.03,5]tetradeca-1,7,9-trien-11-one
[2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethoxy]phenyl] N,N-dimethylcarbamate
6-benzyl-2-(tert-butyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrrolo[3,4-d]pyrimidine-5,8-dione
(2R,3S,9R)-5-Acetyl-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.02,9.03,7.015,18]octadeca-1(17),11(18),12,14-tetraene-4,6-dione
9H-Pyrrolo[1,2:2,3]isoindolo[4,5,6-cd]indol-9-one, 10-acetyl-2,6,6a,7,11a,11b-hexahydro-11-hydroxy-7,7-dimethyl-, (6aR,11aS,11bR)-
validoxylamine A(1+)
An organic cation resulting from the protonation of the amino group of validoxylamine A; major species at pH 7.3.
(1R,3R)-1,3,4,6,7,8-Hexahydro-1,3,9-trimethoxy-7,7-dimethylcyclopenta[g]-2-benzopyran-5-carboxylic acid
(2R,3S,9R)-5-(1-hydroxyethylidene)-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.02,9.03,7.015,18]octadeca-1(17),11(18),12,14-tetraene-4,6-dione
[(3S,4R)-4-(6-methyloctanoyl)-5-oxooxolan-3-yl]methyl dihydrogen phosphate
C14H25O7P (336.13378300000005)
(Z)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(4-phenylbutyl)prop-2-enamide
5-[(4-ethylphenoxy)methyl]-N-(2-pyridinylmethyl)-2-furancarboxamide
4-Oxido-3-(4-phenoxyphenyl)-4a,5,6,7,8,8a-hexahydroquinoxalin-1-ium 1-oxide
4-Hydroxy-1-[1-oxo-2-(phenylmethoxycarbonylamino)propyl]-2-pyrrolidinecarboxylic acid
3,4-dihydro-1H-isoquinolin-2-yl-(1-ethylsulfonyl-4-piperidinyl)methanone
N-(4-methylphenyl)-5-nitro-4-spiro[benzimidazole-2,1-cyclohexane]amine
N-[2-(1-cyclohexenyl)ethyl]-4-[methyl(methylsulfonyl)amino]benzamide
N-(3-methyl-2-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
1-[4-(5-methyl-1H-1,2,3-triazol-1-yl)phenyl]ethanone (4-nitrophenyl)hydrazone
C17H16N6O2 (336.13346759999996)
2-{[(2E)-2-(1-Azabicyclo[2.2.2]octan-3-ylidene)-2-fluoroethyl]oxy}-9H-carbazole
N(alpha)-formyl-N(epsilon)-fructosyllysine
C13H24N2O8 (336.15325839999997)
1,3,5(10)-Estratriene-3-ol sulfate
C18H24O4S (336.13952240000003)
(3E,6Z)-3-benzylidene-6-[(5-tert-butyl-1H-imidazol-4-yl)methylidene]piperazine-2,5-dione
cyclopropyl-[(1S,5R)-7-[4-(3-fluorophenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone
N-[(2R,3S,6R)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-4-fluorobenzamide
N-[(2S,3R,6R)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-4-fluorobenzamide
N-[(2R,3S,6S)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-4-fluorobenzamide
N-[(2S,3S,6R)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-4-fluorobenzamide
N-[(2S,3R,6S)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-4-fluorobenzamide
N-[(2R,3R,6R)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-4-fluorobenzamide
N-[(2R,3R,6S)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-4-fluorobenzamide
N-[(2S,3S,6S)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-4-fluorobenzamide
N-hydroxy-N-[(E)-(2-nitrophenyl)methylideneamino]octanediamide
(1S,18R,20S)-18-methyl-14-oxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4,6,8,15-pentaene-19-carbaldehyde
1,2,5,6-Tetraethyl-1,2,5,6-tetramethyl-1,2,5,6-tetrasilacycloocta-3,7-diyne
C16H32Si4 (336.15809920000004)
10-Acetyl-7,7-dimethyl-6a,7,11a,11b-tetrahydro-6H-pyrrolo[1,2:2,3]isoindolo[4,5,6-cd]indole-9,11(2H,10H)-dione
(6aR,11aS,11bR)-10-acetyl-11-hydroxy-7,7-dimethyl-2,6,6a,7,11a,11b-hexahydro-9H-pyrrolo[1,2:2,3]isoindolo[4,5,6-cd]indol-9-one
Gly-Gly-Phe-Gly
Gly-Gly-Phe-Gly is a peptide spacer and can be applied to Doxorubicin (HY-15142A) (DXR) conjugates[1].
7-hydroxy-5-methoxy-8-(3-methylbut-2-en-1-yl)-4-phenylchromen-2-one
(2r,3s,5e,9s)-5-(1-hydroxyethylidene)-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0²,⁹.0³,⁷.0¹⁵,¹⁸]octadeca-1(17),11(18),12,14-tetraene-4,6-dione
7-[(1s,3s)-3,7-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-3-methylnaphthalen-1-ol
(2s)-5-methoxy-8,8-dimethyl-2-phenyl-2h,3h-pyrano[2,3-f]chromen-4-one
3-[(1s,2r,3r,6s)-3-ethenyl-2-isothiocyanato-3-methyl-6-(prop-1-en-2-yl)cyclohexyl]-1h-indole
9a-hydroxy-4-methoxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h-naphtho[2,3-b]furan-6-yl acetate
7-(6,8-dihydroxy-3-oxo-1,4-dihydro-2-benzopyran-1-yl)heptyl acetate
1-[4-hydroxy-6-methoxy-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-5-yl]-3-phenylprop-2-en-1-one
(3s,7s,8s,11z)-7,8,14,16-tetrahydroxy-3-methyl-3,4,5,6,7,8,9,10-octahydro-2-benzoxacyclotetradecin-1-one
5-hydroxy-7-methoxy-8-(3-methylbuta-1,3-dien-1-yl)-2-phenyl-2,3-dihydro-1-benzopyran-4-one
2-methylpropyl 2-[7-hydroxy-2-(2-hydroxypropyl)-4-oxo-2,3-dihydro-1-benzopyran-5-yl]acetate
4-{5-[4-(acetyloxy)phenyl]penta-1,4-dien-1-yl}phenyl acetate
(2r,10r)-6-methoxy-17,17-dimethyl-3,12,18-trioxapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁴,¹⁹]henicosa-1(21),4,6,8,13,15,19-heptaene
1-(5-hydroxy-7-methoxy-2,2-dimethylchromen-8-yl)-3-phenylprop-2-en-1-one
methyl (13e,14s,16s,18s)-13-ethylidene-9-oxo-1,11-diazapentacyclo[12.3.1.0²,⁷.0⁸,¹⁷.0¹¹,¹⁶]octadeca-2,4,6,8(17)-tetraene-18-carboxylate
11-methoxy-2,2,12-trimethylnaphtho[2,1-f]chromene-8,9-diol
8-(3-hydroxy-3-methylbut-1-en-1-yl)-7-methoxy-2-phenylchromen-4-one
4-{8,8-dimethyl-2h-pyrano[2,3-h]chromen-3-yl}-3-methoxyphenol
(3r)-5-(dimethoxymethyl)-3-hydroxy-6-methoxy-8,8-dimethyl-3h,4h,7h,9h-indeno[4,5-c]pyran-1-one
(3ar,4s,4ar,7r,7as,8r,9as)-7-methoxy-4a,8-dimethyl-3-methylidene-2,5-dioxo-octahydroazuleno[6,5-b]furan-4-yl acetate
4-ethenyl-3-isothiocyanato-4,8,8-trimethyl-14-azatetracyclo[7.6.1.0²,⁷.0¹³,¹⁶]hexadeca-1(15),9(16),10,12-tetraene
(2e)-4-{3,5-dihydroxy-4-[(2r)-2-methylbutanoyl]phenoxy}-2-methylbut-2-en-1-yl acetate
(1s,2r,4r,6s,8s,9z,11s)-8-hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradec-9-en-2-yl propanoate
methyl 10-[(acetyloxy)methyl]-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,10h,11h,11ah-cyclodeca[b]furan-6-carboxylate
(1'r,2's,3s,5's,6'r,8's,11's)-2'-ethenyl-2-hydroxy-4'-methyl-9'-oxa-4'-azaspiro[indole-3,7'-tetracyclo[6.3.1.0²,⁶.0⁵,¹¹]dodecan]-3'-one
(4s,5s,7s)-5-chloro-4-ethenyl-3-isocyano-4,8,8-trimethyl-14-azatetracyclo[7.6.1.0²,⁷.0¹³,¹⁶]hexadeca-1(15),2,9(16),10,12-pentaene
14-acetyl-15-hydroxy-13,13-dimethyl-4,16-diazapentacyclo[12.2.1.1⁹,¹².0²,¹¹.0⁵,¹⁰]octadeca-2,5,7,9,15-pentaen-17-one
7-hydroxy-5,9,9,17-tetramethyl-4-oxa-8,17-diazapentacyclo[10.6.1.0²,¹⁰.0³,⁵.0¹⁶,¹⁹]nonadeca-1,7,10,12,14,16(19)-hexaen-18-one
(2r,3r,5z,9r)-5-(1-hydroxyethylidene)-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0²,⁹.0³,⁷.0¹⁵,¹⁸]octadeca-1(17),11(18),12,14-tetraene-4,6-dione
2-[3-(hydroxymethyl)phenoxy]-3-[2-(4-hydroxyphenyl)ethyl]phenol
3-(3-hydroxy-4-methoxyphenyl)-n-[2-(1h-indol-3-yl)ethyl]prop-2-enimidic acid
5-(1-hydroxyethylidene)-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0²,⁹.0³,⁷.0¹⁵,¹⁸]octadeca-1(17),11(18),12,14-tetraene-4,6-dione
17-epinaucleidinal
{"Ingredient_id": "HBIN002046","Ingredient_name": "17-epinaucleidinal","Alias": "NA","Ingredient_formula": "C20H20N2O3","Ingredient_Smile": "CC1C(C2CC3C4=C(CCN3C(=O)C2=CO1)C5=CC=CC=C5N4)C=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6972","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-hydroxy-9-methoxy-10-(3,3-dimethylallyl)pterocarpene
{"Ingredient_id": "HBIN008689","Ingredient_name": "3-hydroxy-9-methoxy-10-(3,3-dimethylallyl)pterocarpene","Alias": "NA","Ingredient_formula": "C21H20O4","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10397","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8-acetoxy-2-methoxy-10-hydroxy-3,11(13)-guaiadien-12,6-olide
{"Ingredient_id": "HBIN013603","Ingredient_name": "8-acetoxy-2-methoxy-10-hydroxy-3,11(13)-guaiadien-12,6-olide","Alias": "NA","Ingredient_formula": "C18H24O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "251","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-methylpropyl 2-[(2r)-7-hydroxy-2-[(2s)-2-hydroxypropyl]-4-oxo-2,3-dihydro-1-benzopyran-5-yl]acetate
2-[7-(acetyloxy)-8,8a-dimethyl-3-oxo-5,6,7,8-tetrahydronaphthalen-2-yl]-2-methoxypropanoic acid
(6z)-3-benzyl-5-hydroxy-6-[(4-methoxyphenyl)methylidene]-1-methyl-3h-pyrazin-2-one
(6as,8r,9s)-8-chloro-9-ethenyl-6,6,9-trimethyl-5h,6ah,7h,8h-indeno[2,1-b]indole-10-carbonitrile
8-formyl-5,12-dihydroxy-4-methyl-13-oxotetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-4-carboxylic acid
5-acetyl-6-hydroxy-2-(2-methylprop-1-en-1-yl)-3,11-diazatetracyclo[7.6.1.0³,⁷.0¹²,¹⁶]hexadeca-1(16),5,9,12,14-pentaen-4-one
(2r,7r)-7-amino-4-hydroxy-2-(2-hydroxy-3-methoxy-6-methylbenzoyl)-2-methyl-6,7-dihydro-5h-1,3-oxazocin-8-one
2,6-dimethoxy-4-(4-methoxyphenyl)-[1,1'-biphenyl]-3-ol
3-(4-hydroxy-3-methoxyphenyl)-n-[2-(1h-indol-3-yl)ethyl]prop-2-enimidic acid
(1r,2s,7s,8r,9s,12s,17s)-7,8-dihydroxy-1,12,17-trimethyl-10,13-dioxatetracyclo[7.7.1.0²,⁷.0¹¹,¹⁵]heptadec-11(15)-ene-14,16-dione
(1s,18s,19s,20s)-18-methyl-14-oxo-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8,15-pentaene-19-carbaldehyde
1-[7-acetyl-4,6-dihydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]-3-methylbutan-1-one
(1r,2r,7r,8r,9s,12s,17r)-7,8-dihydroxy-1,12,17-trimethyl-10,13-dioxatetracyclo[7.7.1.0²,⁷.0¹¹,¹⁵]heptadec-11(15)-ene-14,16-dione
(1s,3s,4s,5r,8r,9r,12s)-8-formyl-5,12-dihydroxy-4-methyl-13-oxotetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-4-carboxylic acid
(2s)-6-methoxy-8,8-dimethyl-2-phenyl-2h,3h-pyrano[2,3-f]chromen-4-one
2-(4-hydroxyphenyl)-7-methoxy-6-(3-methylbut-2-en-1-yl)chromen-4-one
7-(6,8-dihydroxy-3-oxo-1,4-dihydro-2-benzopyran-1-yl)heptan-2-yl acetate
1-(4-hydroxy-6-oxopyran-2-yl)tridecane-2,4,6-trione
methyl 13-acetyl-1,11-diazapentacyclo[12.3.1.0²,⁷.0⁸,¹⁷.0¹¹,¹⁶]octadeca-2,4,6,8(17),12-pentaene-18-carboxylate
(2z)-3-(3-hydroxy-4-methoxyphenyl)-n-[2-(1h-indol-3-yl)ethyl]prop-2-enimidic acid
8-hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradec-9-en-2-yl propanoate
n-{2,5-dihydroxy-5-[2-(c-hydroxycarbonimidoyl)ethyl]-7-oxabicyclo[4.1.0]hept-3-en-3-yl}octa-2,4-dienimidic acid
8-[(2s)-3-ethoxy-2-hydroxy-3-methylbutyl]-6,7-dimethoxychromen-2-one
3-[(1r,2s,3s,6r)-3-ethenyl-2-isothiocyanato-3-methyl-6-(prop-1-en-2-yl)cyclohexyl]-1h-indole
(2z)-3-(4-hydroxyphenyl)-n-[2-(5-methoxy-1h-indol-3-yl)ethyl]prop-2-enimidic acid
7-amino-4-hydroxy-2-(2-hydroxy-3-methoxy-6-methylbenzoyl)-2-methyl-6,7-dihydro-5h-1,3-oxazocin-8-one
(1'r,2's,3s,5'r,6'r,8'r,11's)-2'-ethenyl-2-hydroxy-4'-methyl-9'-oxa-4'-azaspiro[indole-3,7'-tetracyclo[6.3.1.0²,⁶.0⁵,¹¹]dodecan]-3'-one
methyl 3-(4-{[4-(buta-2,3-dien-1-yloxy)phenyl]methoxy}phenyl)prop-2-enoate
1-[5-acetyl-4,6-dihydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-7-yl]-3-methylbutan-1-one
5-acetyl-4-hydroxy-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0²,⁹.0³,⁷.0¹⁵,¹⁸]octadeca-1(17),4,11(18),12,14-pentaen-6-one
(3ar,4s,4ar,7s,7as,8r,9as)-7-methoxy-4a,8-dimethyl-3-methylidene-2,5-dioxo-octahydroazuleno[6,5-b]furan-4-yl acetate
3-[(1r,2r,3r,6r)-3-ethenyl-2-isothiocyanato-3-methyl-6-(prop-1-en-2-yl)cyclohexyl]-1h-indole
methyl (2s,3s)-3,5,7-trihydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-3,4-dihydro-1-benzopyran-6-carboxylate
8-chloro-9-ethenyl-10-isocyano-6,6,9-trimethyl-5h,6ah,7h,8h-indeno[2,1-b]indole
(2r)-6-methoxy-8,8-dimethyl-2-phenyl-2h,3h-pyrano[2,3-f]chromen-4-one
6-hydroxy-7-methoxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,6ah,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate
9-hydroxy-6-methoxy-6,9-dimethyl-3-methylidene-2-oxo-4h,5h,6ah,7h,8h,9ah-azuleno[4,5-b]furan-4-yl acetate
4-(hydroxymethyl)-3,8,9-trimethyl-3,4-dihydro-2h-1-oxatetraphene-5,12-dione
(3s,5r)-5,14,16-trihydroxy-3-methyl-4,5,6,8,9,10,11,12-octahydro-3h-2-benzoxacyclotetradecine-1,7-dione
[(2r,3r)-3-{3-methoxy-4-[(2-methylpropanoyl)oxy]phenyl}oxiran-2-yl]methyl 2-methylpropanoate
2-{2-[(acetyloxy)methyl]oxiran-2-yl}-4-methoxy-5-methylphenyl 3-methylbutanoate
1-(4-hydroxyphenyl)-3-(5-methoxy-2,2-dimethylchromen-6-yl)prop-2-en-1-one
(4r,12s)-8-methoxy-12-phenyl-4-(prop-1-en-2-yl)-5,13-dioxatricyclo[7.4.0.0²,⁶]trideca-1(9),2(6),7-trien-10-one
(2r,3r,4s,5r,6s)-2-(hydroxymethyl)-6-[4-(1h-imidazol-2-ylmethyl)phenoxy]oxane-3,4,5-triol
7-(3,7-dimethoxy-1,3-dihydro-2-benzofuran-1-yl)-3-methylnaphthalen-1-ol
8-{2-hydroxy-3-[(2-hydroxypropan-2-yl)oxy]-3-methylbutyl}-7-methoxychromen-2-one
(2e)-3-(4-hydroxyphenyl)-n-[2-(5-methoxy-1h-indol-3-yl)ethyl]prop-2-enimidic acid
(4e)-5-{[(1e,5e,8e,11z)-1-chlorotetradeca-1,5,8,11,13-pentaen-1-yl]oxy}pent-4-enoic acid
C19H25ClO3 (336.14921300000003)
(2z)-3-(4-hydroxy-3-methoxyphenyl)-n-[2-(1h-indol-3-yl)ethyl]prop-2-enimidic acid
4-[3,5-dihydroxy-4-(2-methylbutanoyl)phenoxy]-2-methylbut-2-en-1-yl acetate
(2r,4s)-4-(4-hydroxy-5-methoxynaphthalen-1-yl)-2-methyl-3,4-dihydro-2h-1-benzopyran-5-ol
(2r,7s)-5-acetyl-6-hydroxy-2-(2-methylprop-1-en-1-yl)-3,11-diazatetracyclo[7.6.1.0³,⁷.0¹²,¹⁶]hexadeca-1(16),5,9,12,14-pentaen-4-one
5-hydroxy-8-(4-hydroxyphenyl)-2,2-dimethyl-7h,8h,9h-cyclohexa[g]chromen-6-one
7-hydroxy-3-[4-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]chromen-4-one
(1'r,2's,3s,6'r,8'r,11's)-2'-ethenyl-2-hydroxy-4'-methyl-9'-oxa-4'-azaspiro[indole-3,7'-tetracyclo[6.3.1.0²,⁶.0⁵,¹¹]dodecan]-3'-one
(2e)-3-(4-hydroxy-3-methoxyphenyl)-n-[2-(1h-indol-3-yl)ethyl]prop-2-enimidic acid
(3s)-5,14,16-trihydroxy-3-methyl-4,5,6,8,9,10,11,12-octahydro-3h-2-benzoxacyclotetradecine-1,7-dione
(1s,18r,19s,20s)-18-methyl-14-oxo-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8,15-pentaene-19-carbaldehyde
(1s,12s)-23,23-dimethyl-5,7,17-trioxa-23-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹³,²¹.0¹⁵,¹⁹]tricosa-2,4(8),9,13,15(19),20-hexaen-23-ium
7,8-dihydroxy-1,12,17-trimethyl-10,13-dioxatetracyclo[7.7.1.0²,⁷.0¹¹,¹⁵]heptadec-11(15)-ene-14,16-dione
5-(6,7-dimethoxy-2,3-dimethylnaphthalen-1-yl)-2h-1,3-benzodioxole
2-methylpropyl 2-[(2s)-7-hydroxy-2-[(2s)-2-hydroxypropyl]-4-oxo-2,3-dihydro-1-benzopyran-5-yl]acetate
7-hydroxy-3-(4-methoxyphenyl)-8-(3-methylbut-2-en-1-yl)chromen-4-one
1-(7-hydroxy-5-methoxy-2,2-dimethylchromen-6-yl)-3-phenylprop-2-en-1-one
(2r)-2-[(7s,8r,8ar)-7-(acetyloxy)-8,8a-dimethyl-3-oxo-5,6,7,8-tetrahydronaphthalen-2-yl]-2-methoxypropanoic acid
(2r,5r)-2-(4-hydroxybenzoyl)-5-isopropyl-3,5-dimethoxypyrazine-2,6-diol
(1s,10s)-10-hydroxy-1,6-dimethyl-10-(2-oxopropyl)-1h,2h-phenanthro[1,2-b]furan-11-one
(1s,14s,18s,19r)-8,10-dioxa-4,17-diazaheptacyclo[15.4.3.0¹,¹⁸.0⁴,¹⁹.0⁵,¹³.0⁷,¹¹.0¹⁴,¹⁹]tetracosa-5,7(11),12,22-tetraen-3-one
4-{8,8-dimethyl-2h-pyrano[2,3-h]chromen-4-yl}-3-methoxyphenol
4-(1-hydroxy-8-methoxynaphthalen-2-yl)-2-methyl-3,4-dihydro-2h-1-benzopyran-5-ol
17-methyl-18,22-dioxa-4,14-diazahexacyclo[14.6.1.0²,¹⁴.0³,¹¹.0⁵,¹⁰.0²⁰,²³]tricosa-3(11),5,7,9,19-pentaen-21-one
(3r,5s)-7-hydroxy-5,9,9,17-tetramethyl-4-oxa-8,17-diazapentacyclo[10.6.1.0²,¹⁰.0³,⁵.0¹⁶,¹⁹]nonadeca-1,7,10,12,14,16(19)-hexaen-18-one
6-[(3e,5z,8e,10e)-11-chloro-7,10-dimethylundeca-3,5,8,10-tetraen-1-yl]-4-methoxy-5,6-dihydropyran-2-one
C19H25ClO3 (336.14921300000003)