Exact Mass: 428.1072

Exact Mass Matches: 428.1072

Found 372 metabolites which its exact mass value is equals to given mass value 428.1072, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Wortmannin

11-(acetyloxy)-1S,6bR,7,8,9aS,10,11R,11bR-octahydro-1-(methoxymethyl)-9a,11b-dimethyl-3H-furo[4,3,2-de]indeno[4,5-h]-2-benzopyran-3,6,9-trione

C23H24O8 (428.1471)

D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D007329 - Insulin Antagonists C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2152 - Phosphatidylinositide 3-Kinase Inhibitor D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor D011838 - Radiation-Sensitizing Agents

SB243213A

SB 243213

C22H19F3N4O2 (428.146)

CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9396; ORIGINAL_PRECURSOR_SCAN_NO 9395 CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4902; ORIGINAL_PRECURSOR_SCAN_NO 4900 CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4912; ORIGINAL_PRECURSOR_SCAN_NO 4909 CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4923; ORIGINAL_PRECURSOR_SCAN_NO 4921 CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4882; ORIGINAL_PRECURSOR_SCAN_NO 4879 CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9448; ORIGINAL_PRECURSOR_SCAN_NO 9447 CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9442; ORIGINAL_PRECURSOR_SCAN_NO 9439 INTERNAL_ID 630; CONFIDENCE standard compound; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9448; ORIGINAL_PRECURSOR_SCAN_NO 9447 CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4910; ORIGINAL_PRECURSOR_SCAN_NO 4906 CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9358; ORIGINAL_PRECURSOR_SCAN_NO 9357 CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9440; ORIGINAL_PRECURSOR_SCAN_NO 9438 CONFIDENCE standard compound; INTERNAL_ID 630; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9390; ORIGINAL_PRECURSOR_SCAN_NO 9387

Quizalofop-P-tefuryl

C22H21ClN2O5 (428.1139)

fosfestrol

Diethylstilbestrol Diphosphate

C18H22O8P2 (428.079)

L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02A - Hormones and related agents > L02AA - Estrogens C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D000970 - Antineoplastic Agents

Eupachloroxin

C20H25ClO8 (428.1238)

beta-Peltatin A methyl ether

C23H24O8 (428.1471)

Rhodomycinone

ε-Rhodomycinone

C22H20O9 (428.1107)

A carboxylic ester that is the methyl ester of (1R,2R,4S)-2-ethyl-2,4,5,7,12-pentahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylic acid.

Eltanexor

C17H10F6N6O (428.082)

C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor

Theaflavic acid

3,4,6-trihydroxy-5-oxo-1-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)-5H-benzo[7]annulene-8-carboxylic acid

C21H16O10 (428.0743)

Epitheaflavic acid is found in tea. Epitheaflavic acid is isolated from black tea Camellia sinensis. Isolated from black tea Camellia sinensis. Epitheaflavic acid is found in tea.

b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-L-arabinose

3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}oxy)oxane-2,4,5-triol

C16H28O13 (428.153)

b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-L-arabinose is found in fruits. b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-L-arabinose is a constituent of Acutosides from Luffa acutangula (Chinese okra). Constituent of Acutosides from Luffa acutangula (Chinese okra). b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-L-arabinose is found in fruits.

Lacosamide-glucuronide

6-({[(1R)-1-(benzylcarbamoyl)-2-methoxyethyl]carbamoyl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C18H24N2O10 (428.1431)

Lacosamide-glucuronide is a metabolite of lacosamide. Lacosamide (INN, formerly known as erlosamide) is a medication developed by UCB for the adjunctive treatment of partial-onset seizures and diabetic neuropathic pain marketed under the trade name Vimpat. The U.S. Food and Drug Administration accepted UCBs New Drug Application for lacosamide as of November 29, 2007, beginning the approval process for the drug. (Wikipedia)

3-Chloro-2-methyl-N-(4-(2-(4-methylpiperazin-1-yl)-2-oxoethyl)thiazol-2-yl)benzenesulfonamide

3-chloro-2-methyl-N-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl}benzene-1-sulfonamide

C17H21ClN4O3S2 (428.0744)

(E)-4,4'-(Hex-3-ene-3,4-diyl)bis(4,1-phenylene) bis(dihydrogen phosphate)

(e)-4,4-(Hex-3-ene-3,4-diyl)bis(4,1-phenylene) bis(dihydrogen phosphoric acid)

C18H22O8P2 (428.079)

Halobetasol

14-(2-chloroacetyl)-1,8-difluoro-14,17-dihydroxy-2,13,15-trimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-3,6-dien-5-one

C22H27ClF2O4 (428.1566)

[4-[4-(4-Hydroxyphenyl)hex-3-en-3-yl]phenyl] phosphono hydrogen phosphate

{[hydroxy({4-[4-(4-hydroxyphenyl)hex-3-en-3-yl]phenoxy})phosphoryl]oxy}phosphonic acid

C18H22O8P2 (428.079)

Balipodect

1-[2-fluoro-4-(1H-pyrazol-1-yl)phenyl]-5-methoxy-3-(1-phenyl-1H-pyrazol-5-yl)-1,4-dihydropyridazin-4-one

C23H17FN6O2 (428.1397)

wortmannin

18-(Methoxymethyl)-1,5-dimethyl-6,11,16-trioxo-13,17-dioxapentacyclo[10.6.1.0²,¹⁰.0⁵,⁹.0¹⁵,¹⁹]nonadeca-2(10),12(19),14-trien-3-yl acetic acid

C23H24O8 (428.1471)

12a-Hydroxyamorphigenin

C23H24O8 (428.1471)

Venkatasin

C22H20O9 (428.1107)

Catechin 3-O-(1-hydroxy-6-oxo-2-cyclohexene-1-carboxylate)

(2R,3S) -3,5,7,3,4-Pentahydroxyflavan 3-O- (1-hydroxy-6-oxo-2-cyclohexene-1-carboxylate)

C22H20O9 (428.1107)

A pyranone that is a carboxylic ester of cis-4-coumaric acid. It is isolated from the whole plant of Hyptis brevipes and has been found to exhibit cytotoxicity against HT-29 and MCF-7 cancer cells.

Eupachinilide E

C20H25ClO8 (428.1238)

Derrisin

(6aS,12aS,4S,5R)-4,5-Dihydroxy-2,3,4-dimethoxy-6,6-dimethyl-4,5-dihydropyrano[2,3:9,8]rotenone

C23H24O8 (428.1471)

Grandiuvarin B

C23H24O8 (428.1471)

5,7-Dihydroxy-3-(2-hydroxy-3-methyl-3-butenyl)-3,6,4-trimethoxyflavone

C23H24O8 (428.1471)

Hyosgerin

C22H20O9 (428.1107)

2-Hydroxyaklavinone

C22H20O9 (428.1107)

3,5-Diacetyltambulin

3,5-Bis (acetyloxy) -7,8-dimethoxy-2- (4-methoxyphenyl) -4H-1-benzopyran-4-one

C22H20O9 (428.1107)

5,4-Dihydroxy-3,6,3-trimethoxy-7-prenyloxyflavone

C23H24O8 (428.1471)

5,4-Dihydroxy-3,8,3-trimethoxy-7-prenyloxyflavone

C23H24O8 (428.1471)

5,7-Dihydroxy-3,8,3-trimethoxy-4-prenyloxyflavone

C23H24O8 (428.1471)

9-(1,1-Dimethyl-2-propenyl)-2,3-dihydro-3,6,7,11-tetrahydroxy-2-(1-hydroxy-1-methylethyl)-5H-furo[3,2-b]xanthen-5-on

C23H24O8 (428.1471)

HMS1662J14

C18H19F3N4O5 (428.1307)

O1-Cinnamoyl-3-[3,5-bis(trifluoromethyl)phenyl]prop-2-enehydroximamide

C20H14F6N2O2 (428.0959)

CHEMBL3827297

C17H16N8O4S (428.1015)

MEGxm0_000409

C22H20O9 (428.1107)

MCULE-6092161355

C23H24O8 (428.1471)

Eta-Pyrromycinon

C22H20O9 (428.1107)

5-O-alpha-D-Glucopyranoside-9-Deazaadenosine

C17H24N4O9 (428.1543)

C18H20O10S

C18H20O10S (428.0777)

bromosphaerene

C20H30Br2 (428.0714)

Sublobaric acid

C23H24O8 (428.1471)

CHEMBL516734

C21H16O10 (428.0743)

4-(3,4-Dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carboxylic acid 1,2-dicarboxyethyl ester

C21H16O10 (428.0743)

Me glycoside-beta-Pyranose-Xylotriose

C16H28O13 (428.153)

C22H20O9

C22H20O9 (428.1107)

1-Butanoyl-2,4,5,7,8-pentamethoxy-anthrachinon|1-Butyryl-2,4,5,7,8-pentamethoxy-anthrachinon

C23H24O8 (428.1471)

SCHEMBL6368334

C21H16O10 (428.0743)

Aglycone-Chromocyclomycin

C22H20O9 (428.1107)

CHEMBL477922

C21H16O10 (428.0743)

ACMC-20mit2

C23H24O8 (428.1471)

ACMC-20mmzk

C24H25ClO5 (428.139)

ACMC-20mczi

C21H16O10 (428.0743)

3,7-Dihydroxy-3-(2-hydroxy-3-methyl-3-butenyl)-4,5,6-trimethoxyflavone

C23H24O8 (428.1471)

Ac-Guayadequiol|guayadequiol acetate

C23H24O8 (428.1471)

2-(1-O-feruloyl-2-hydroxyisopropyl)-5,6-dimethoxybenzofuran

C23H24O8 (428.1471)

Arboreol

C23H24O8 (428.1471)

Deoxyenterocin

C22H20O9 (428.1107)

C16H28O13

C16H28O13 (428.153)

beta-peltatin methyl ether

C23H24O8 (428.1471)

2,3-O-Isopropylidene,1,6-dibenzoyl-Tagatose,,

C23H24O8 (428.1471)

delta-Rhodomycinone

C22H20O9 (428.1107)

picraquassioside B

C19H24O11 (428.1319)

(1alpha,2beta,3alpha)-Tribenzoyl-4-Cyclopentene-1,2,3-triol

C26H20O6 (428.126)

2,7,8-Tri-Me ether,di-Ac-2,3,5,7,8-Pentahydroxyflavone

C22H20O9 (428.1107)

(5E,8Z,14Z)-6-iodoicosa-5,8,14-trien-11-ynoic acid

C20H29IO2 (428.1212)

canthin-6-one-9-methoxy-5-O-beta-D-glucopyranoside

C21H20N2O8 (428.122)

mimulone E

C23H24O8 (428.1471)

duramidine D

C20H20N4O7 (428.1332)

7-O-beta-D-(6-O-malonyl)glucopyranosyl-5-methoxy-1(3H)-isobenzofuranone

C18H20O12 (428.0955)

halawanone B

C22H20O9 (428.1107)

SCHEMBL16552234

C23H24O8 (428.1471)

C20H30Br2

C20H30Br2 (428.0714)

3,8-dihydroxy-11-oxo-1-pentanoyl-6-propyl-11H-dibenzo[b,e][1,4]dioxepine-7-carboxylic acid methyl ester|Conloxodin|Couloxodin

C23H24O8 (428.1471)

6-oxo-6a,12a-dehydrodeguelin

C23H24O8 (428.1471)

zeta-Isohodomycinone

C22H20O9 (428.1107)

(-)-3-hydroxy-N-methylwelwitindolinone C isothiocyanate|3-hydroxy-N-methylwelwitindolinone C isothiocyanate

C22H21ClN2O3S (428.0961)

C23H24O8

C23H24O8 (428.1471)

Yadanziolide A

C19H24O11 (428.1319)

SCHEMBL12228143

C22H20O7S (428.093)

CHEMBL491522

C23H24O8 (428.1471)

neopargueroldione

C20H29BrO5 (428.1198)

Eupomatilone 1

C23H24O8 (428.1471)

rosratin A|rostratin A

C18H24N2O6S2 (428.1076)

Tubercidin 5-alpha-D-glucopyranose

C17H24N4O9 (428.1543)

C21H20N2O8

C21H20N2O8 (428.122)

3,4,6-Trimethoxy-3-(2-hydroxy-3-methyl-3-butenyl)-5,7-dihydroxyflavone

C23H24O8 (428.1471)

9-(1,1-dimethylprop-2-en-1-yl)-3,6,7,11-tetrahydroxy-2-(1-hydroxy-1-methylethyl)-2,3-dihydro-5H-furo[3,2-b]xanthen-5-one

C23H24O8 (428.1471)

NCGC00384996-01!

C22H20O9 (428.1107)

9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one

NCGC00347590-02!9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one

C23H24O8 (428.1471)

NCGC00385138-01!

C23H24O8 (428.1471)

SMZ-Pt

C17H16N8O4S (428.1015)

CONFIDENCE Probable structure via diagnostic evidence, tentative identification (Level 2b); ALGAE_TP_ID 3102

15-(1,3-dihydroxy-3-methylbutyl)-2,4,18-trihydroxy-7,9,13-trioxapentacyclo[10.8.0.0³,¹⁰.0⁴,⁸.0¹⁴,¹⁹]icosa-1(12),2,5,10,14,16,18-heptaen-20-one

C22H20O9 (428.1107)

1,2-dihydro-2,6-dihydroxyrotenone

C23H24O8 (428.1471)

9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one

C23H24O8 (428.1471)

Rutilantinone

C22H20O9 (428.1107)

9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one [IIN-based on: CCMSLIB00000847582]

NCGC00347590-02!9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one [IIN-based on: CCMSLIB00000847582]

C23H24O8 (428.1471)

9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one [IIN-based: Match]

NCGC00347590-02!9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one [IIN-based: Match]

C23H24O8 (428.1471)

9,11,12a-trihydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6,6a-dihydrochromeno[3,4-b]chromen-12-one_major

C23H24O8 (428.1471)

15-(1,3-dihydroxy-3-methylbutyl)-2,4,18-trihydroxy-7,9,13-trioxapentacyclo[10.8.0.0³,¹⁰.0⁴,⁸.0¹⁴,¹⁹]icosa-1(12),2,5,10,14,16,18-heptaen-20-one_major

C22H20O9 (428.1107)

15-(1,3-dihydroxy-3-methylbutyl)-2,4,18-trihydroxy-7,9,13-trioxapentacyclo[10.8.0.0³,¹?.0?,?.0¹?,¹?]icosa-1(12),2,5,10,14,16,18-heptaen-20-one

C22H20O9 (428.1107)

Cys Cys Cys Thr

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

C13H24N4O6S3 (428.0858)

Cys Cys Phe Gly

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

C17H24N4O5S2 (428.1188)

Cys Cys Gly Phe

(2S)-2-{2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]acetamido}-3-phenylpropanoic acid

C17H24N4O5S2 (428.1188)

Cys Cys Thr Cys

(2R)-2-[(2S,3R)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-sulfanylpropanoic acid

C13H24N4O6S3 (428.0858)

Cys Phe Cys Gly

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

C17H24N4O5S2 (428.1188)

Cys Phe Gly Cys

(2R)-2-{2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]acetamido}-3-sulfanylpropanoic acid

C17H24N4O5S2 (428.1188)

Cys Gly Cys Phe

(2S)-2-[(2R)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-3-sulfanylpropanamido]-3-phenylpropanoic acid

C17H24N4O5S2 (428.1188)

Cys Gly Phe Cys

(2R)-2-[(2S)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-3-phenylpropanamido]-3-sulfanylpropanoic acid

C17H24N4O5S2 (428.1188)

Cys Gly Ser Tyr

(2S)-2-[(2S)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanoic acid

C17H24N4O7S (428.1366)

Cys Gly Tyr Ser

(2S)-2-[(2S)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanoic acid

C17H24N4O7S (428.1366)

Cys Ser Gly Tyr

(2S)-2-{2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]acetamido}-3-(4-hydroxyphenyl)propanoic acid

C17H24N4O7S (428.1366)

Cys Ser Tyr Gly

2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]acetic acid

C17H24N4O7S (428.1366)

Cys Thr Cys Cys

(2R)-2-[(2R)-2-[(2S,3R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C13H24N4O6S3 (428.0858)

Cys Tyr Gly Ser

(2S)-2-{2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]acetamido}-3-hydroxypropanoic acid

C17H24N4O7S (428.1366)

Cys Tyr Ser Gly

2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]acetic acid

C17H24N4O7S (428.1366)

2H-1-Benzopyran-2-one, 6-(1,2-dihydroxyethyl)-7-hydroxy-8-methoxy- glucuronide

C18H20O12 (428.0955)

Phe Cys Cys Gly

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

C17H24N4O5S2 (428.1188)

Phe Cys Gly Cys

(2R)-2-{2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]acetamido}-3-sulfanylpropanoic acid

C17H24N4O5S2 (428.1188)

Phe Gly Cys Cys

(2R)-2-[(2R)-2-{2-[(2S)-2-amino-3-phenylpropanamido]acetamido}-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C17H24N4O5S2 (428.1188)

Gly Cys Cys Phe

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

C17H24N4O5S2 (428.1188)

Gly Cys Phe Cys

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

C17H24N4O5S2 (428.1188)

Gly Cys Ser Tyr

(2S)-2-[(2S)-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanoic acid

C17H24N4O7S (428.1366)

Gly Cys Tyr Ser

(2S)-2-[(2S)-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanoic acid

C17H24N4O7S (428.1366)

Gly Phe Cys Cys

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

C17H24N4O5S2 (428.1188)

Gly Ser Cys Tyr

(2S)-2-[(2R)-2-[(2S)-2-(2-aminoacetamido)-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanoic acid

C17H24N4O7S (428.1366)

Gly Ser Tyr Cys

(2R)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanoic acid

C17H24N4O7S (428.1366)

Gly Tyr Cys Ser

(2S)-2-[(2R)-2-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-hydroxypropanoic acid

C17H24N4O7S (428.1366)

Gly Tyr Ser Cys

(2R)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-3-sulfanylpropanoic acid

C17H24N4O7S (428.1366)

Phenytoin-N-glucuronide

C21H20N2O8 (428.122)

Diethylstilbestryl disulfate

C18H20O8S2 (428.06)

Ser Cys Gly Tyr

(2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]acetamido}-3-(4-hydroxyphenyl)propanoic acid

C17H24N4O7S (428.1366)

Ser Cys Tyr Gly

2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]acetic acid

C17H24N4O7S (428.1366)

Ser Gly Cys Tyr

(2S)-2-[(2R)-2-{2-[(2S)-2-amino-3-hydroxypropanamido]acetamido}-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanoic acid

C17H24N4O7S (428.1366)

Ser Gly Tyr Cys

(2R)-2-[(2S)-2-{2-[(2S)-2-amino-3-hydroxypropanamido]acetamido}-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanoic acid

C17H24N4O7S (428.1366)

Ser Tyr Cys Gly

2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]acetic acid

C17H24N4O7S (428.1366)

Ser Tyr Gly Cys

(2R)-2-{2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]acetamido}-3-sulfanylpropanoic acid

C17H24N4O7S (428.1366)

Thr Cys Cys Cys

(2R)-2-[(2R)-2-[(2R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C13H24N4O6S3 (428.0858)

Tyr Cys Gly Ser

(2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]acetamido}-3-hydroxypropanoic acid

C17H24N4O7S (428.1366)

Tyr Cys Ser Gly

2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-hydroxypropanamido]acetic acid

C17H24N4O7S (428.1366)

Tyr Gly Cys Ser

(2S)-2-[(2R)-2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}-3-sulfanylpropanamido]-3-hydroxypropanoic acid

C17H24N4O7S (428.1366)

Tyr Gly Ser Cys

(2R)-2-[(2S)-2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}-3-hydroxypropanamido]-3-sulfanylpropanoic acid

C17H24N4O7S (428.1366)

Tyr Ser Cys Gly

2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-3-sulfanylpropanamido]acetic acid

C17H24N4O7S (428.1366)

Tyr Ser Gly Cys

(2R)-2-{2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]acetamido}-3-sulfanylpropanoic acid

C17H24N4O7S (428.1366)

Theaflavic acid

3,4,6-trihydroxy-5-oxo-1-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)-5H-benzo[7]annulene-8-carboxylic acid

C21H16O10 (428.0743)

b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-L-arabinose

3-({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}oxy)oxane-2,4,5-triol

C16H28O13 (428.153)

Emeguisin B

C24H25O5Cl (428.139)

2,2-bipyridyl-4,4-diphosphonic ethyl ester

C18H26N2O6P2 (428.1266)

4,4-[1,4-Phenylenebis(oxy)]bis[3-(trifluoromethyl)aniline]

C20H14F6N2O2 (428.0959)

Benzoic acid,2-hydroxy-, tributylstannyl ester

C19H32O3Sn (428.1373)

cadmium isononanoate

C18H34CdO4 (428.1491)

COMU

C12H19F6N4O4P (428.1048)

4-N-OCTYLOXYBENZOIC ACID 2,4,5-TRICHLOROPHENYL ESTER

C21H23Cl3O3 (428.0713)

Tetraphenylstannane

C24H20Sn (428.0587)

(3AR,4R,5R,6AS)-4-((E)-3,3-DIFLUORO-4-PHENOXYBUT-1-EN-1-YL)-2-OXOHEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL BENZOATE

C24H22F2O5 (428.1435)

N-[4-[4-(benzylideneamino)-3-chlorophenyl]-2-chlorophenyl]-1-phenylmethanimine

C26H18Cl2N2 (428.0847)

1,3-bis(diphenylphosphino)propane monooxide

C27H26OP2 (428.1459)

2-(trimethylsilyl)ethoxymethyltriphenylphosphonium chloride

C24H30ClOPSi (428.1492)

Bromo(tetrabutyl)stiborane

C16H36BrSb (428.1038)

benzene-1,4-diamine,5-(1,3-dioxoisoindole-5-carbonyl)isoindole-1,3-dione

C23H16N4O5 (428.1121)

Darbufelone mesilate

C19H28N2O5S2 (428.144)

5-cyano-N-[[(2R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]carbamoyl]-6-(4-methylphenyl)sulfanylpyridine-3-carboxamide

C20H20N4O5S (428.1154)

2-benzofuran-1,3-dione,furan-2,5-dione,2-(2-hydroxyethoxy)ethanol,propane-1,2-diol

C19H24O11 (428.1319)

N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]naphthalene-2-sulfonamide

C24H16N2O4S (428.0831)

Fluorescent Brightener KS-N

C29H20N2O2 (428.1525)

1-Boc-4-(3-Iodo-1H-indazol-4-yl)piperazine

C16H21IN4O2 (428.0709)

1,1,2,2-tetrakis(4-ethynylphenyl)ethane

C34H20 (428.1565)

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

C23H16N4O5 (428.1121)

Bromo-PEG5-Boc

C17H33BrO7 (428.141)

Fmoc-Phe(4-N3)-OH

C24H20N4O4 (428.1484)

2,2-(3-Bromo-4-methylthiophene-2,5-diyl)bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolane)

C17H27B2BrO4S (428.0999)

5 12-BIS(PHENYLETHYNYL)NAPHTHACENE TEC&

C34H20 (428.1565)

tert-Butyl 4-(3-iodo-1H-indazol-6-yl)piperazine-1-carboxylate

C16H21IN4O2 (428.0709)

1-[(Triisopropylsilyl)ethynyl]-1,2-benziodoxol-3(1H)-one

C18H25IO2Si (428.0668)

1-(4-nitrophenoxy)-2-[2-(4-nitrophenoxy)phenyl]benzene

C24H16N2O6 (428.1008)

1-[3,6-bis[4-(trifluoromethyl)phenyl]-1H-1,2,4,5-tetrazin-2-yl]propan-1-one

C19H14F6N4O (428.1072)

PD 180970

C21H15Cl2FN4O (428.0607)

Halobetasol

C22H27ClF2O4 (428.1566)

D - Dermatologicals > D07 - Corticosteroids, dermatological preparations > D07A - Corticosteroids, plain > D07AC - Corticosteroids, potent (group iii) C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents

Uprosertib

C18H16Cl2F2N4O2 (428.0618)

C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C155764 - AKT Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor Uprosertib (GSK2141795) is a potent and selective pan-Akt inhibitor with IC50 values of 180/328/38 nM for Akt1/Akt2/Akt3, respectively.

Benzoic acid, 2-((3S,4R)-3,4-dihydro-4-hydroxy-3-(phenylmethyl)-2H-1-benzopyran-7-yl)-4-(trifluoromethyl)-

C24H19F3O4 (428.1235)

(R)-3-((N-(1-(4-fluorophenyl)ethyl)quinoline-3-carboxamido)methyl)benzoic acid

C26H21FN2O3 (428.1536)

Balipodect

C23H17FN6O2 (428.1397)

C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent

3-Phenyl-3-({[4-(4-pyridin-4-ylphenyl)thien-2-YL]carbonyl}amino)propanoic acid

C25H20N2O3S (428.1195)

Tetrahydrothiamine diphosphate

C12H22N4O7P2S (428.0684)

5-methyl-N-[6-(2-methylpyridin-3-yl)oxypyridin-3-yl]-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide

C22H19F3N4O2 (428.146)

SB 243213 is an orally active, selective and high-affinity 5-HT2C receptor antagonist with a pKi of 9.37 and a pKb of 9.8 for human 5-HT2C receptor. SB 243213 shows greater than a 100-fold selectivity over a wide range of neurotransmitter receptors, enzymes and ion channels. SB 243213 has improved anxiolytic profile and has the potential for schizophrenia and motor disorders[1].

Rotenone, dihydro-dihydroxy-

C23H24O8 (428.1471)

Octahelicene

C34H20 (428.1565)

Pantera

C22H21ClN2O5 (428.1139)

methyl 2-[2-chloro-6-ethoxy-4-[(Z)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenoxy]acetate

C22H21ClN2O5 (428.1139)

SJ-172550 is a small molecule inhibitor of MDMX; competes for the wild type p53 peptide binding to MDMX with an EC50 of 5 μM.

4-[bis(2-methoxyethyl)sulfamoyl]-N-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]benzamide

C17H24N4O7S (428.1366)

N-(4-hydroxyphenyl)-4-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide

C21H20N2O4S2 (428.0864)

1,7-Bis(4-hydroxy-3,5-dimethoxyphenyl)hepta-1,6-diene-3,5-dione

C23H24O8 (428.1471)

15-(1,3-Dihydroxy-3-methylbutyl)-2,4,18-trihydroxy-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

C22H20O9 (428.1107)

4-[[Glutamic acid]-carbonyl]-benzene-sulfonyl-d-proline

C17H20N2O9S (428.0889)

2-[1-(4-Chlorobenzoyl)-5-Methoxy-2-Methyl-1h-Indol-3-Yl]-N-[(1r)-1-(Hydroxymethyl)propyl]acetamide

C23H25ClN2O4 (428.1503)

2-[1-(4-Chlorobenzoyl)-5-Methoxy-2-Methyl-1h-Indol-3-Yl]-N-[(1s)-1-(Hydroxymethyl)propyl]acetamide

C23H25ClN2O4 (428.1503)

Methyl 4-Bromo-N-[8-(Hydroxyamino)-8-Oxooctanoyl]-L-Phenylalaninate

C18H25BrN2O5 (428.0947)

(3s)-3-Cyclopentyl-6-Methyl-7-[(4-Methylpiperazin-1-Yl)sulfonyl]-3,4-Dihydro-2h-1,2,4-Benzothiadiazine 1,1-Dioxide

C18H28N4O4S2 (428.1552)

3,4,5-trihydroxy-6-oxo-1-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)benzo[7]annulene-8-carboxylic acid

C21H16O10 (428.0743)

epsilon-rhodomycinone

C22H20O9 (428.1107)

[Pks-acp]-group

C14H27N3O8PS- (428.1256)

GS-methylhydroquinone

C17H22N3O8S- (428.1128)

(2S)-2-[(2R,3R,4R,5S,6R)-3-[[(2R)-2-amino-3-(hydroxymethylsulfanyl)propanoyl]amino]-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanedioic acid

C14H24N2O11S (428.1101)

[4-[4-(4-Hydroxyphenyl)hex-3-en-3-yl]phenyl] phosphono hydrogen phosphate

C18H22O8P2 (428.079)

Epsilon-pyrromycinone

C22H20O9 (428.1107)

rostratin A

C18H24N2O6S2 (428.1076)

An organic disulfide isolated from the whole broth of the marine-derived fungus Exserohilum rostratum and has been shown to exhibit antineoplastic activity.

Wortmannin from Penicillium funiculosum

C23H24O8 (428.1471)

Zofenopril(1-)

C22H22NO4S2- (428.099)

Octacene

C34H20 (428.1565)

brevipolide A

C23H24O8 (428.1471)

A pyranone that is a carboxylic ester of trans-4-coumaric acid. It is isolated from the whole plant of Hyptis brevipes and has been found to exhibit cytotoxicity against HT-29 cancer cells.

2-[4-chloro-5-(cyclopentylsulfamoyl)-2-methylphenoxy]-N-cyclohexylacetamide

C20H29ClN2O4S (428.1536)

4-{[(1,3-diphenyl-1H-pyrazol-4-yl)methylene]amino}-5-(2-thienyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

C22H16N6S2 (428.0878)

Octaphene

C34H20 (428.1565)

N-(3,4-dimethylphenyl)-3-methyl-5-(4-morpholinylsulfonyl)-2-benzofurancarboxamide

C22H24N2O5S (428.1406)

N-[4-(4-methyl-2-thiazolyl)-2-phenyl-3-pyrazolyl]-3-(trifluoromethyl)benzamide

C21H15F3N4OS (428.0919)

3-[(4-Methylphenyl)sulfamoyl]benzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester

C21H20N2O6S (428.1042)

3-[[Oxo-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methoxy]methyl]benzoic acid ethyl ester

C25H20N2O5 (428.1372)

2-[[2-[(4-Methoxyphenyl)methyl]-1,3-dioxo-4-isoquinolinylidene]methylamino]benzoic acid

C25H20N2O5 (428.1372)

ethyl {1-[(9-methyl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-2-yl)carbonyl]-3-oxopiperazin-2-yl}acetate

C20H20N4O5S (428.1154)

2-(4-bromophenyl)-2-hydroxy-1-[4-(1H-indazol-5-ylamino)-1-piperidinyl]ethanone

C20H21BrN4O2 (428.0848)

S-butyryl-4-phosphopantetheine

C15H29N2O8PS (428.1382)

An S-acyl-4-phosphopantetheine obtained by formal condensation of the thiol group of D-pantetheine 4-phosphate with the carboxy group of butyric acid.

N-(2-methoxyethyl)-4-[4-(2-methoxyethylsulfamoyl)phenyl]benzenesulfonamide

C18H24N2O6S2 (428.1076)

N-[4-[4-(ethylsulfonylamino)-3-methoxyphenyl]-2-methoxyphenyl]ethanesulfonamide

C18H24N2O6S2 (428.1076)

[2-(3-Chlorophenyl)-4-quinolinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone

C25H21ClN4O (428.1404)

N-(3-chloro-4-fluorophenyl)-2-[5-(dimethylsulfamoyl)-2-(ethylamino)anilino]acetamide

C18H22ClFN4O3S (428.1085)

ethyl 2-[(1-ethylbenzimidazol-2-yl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate

C20H20N4O3S2 (428.0977)

4-(3,5-Dimethyl-1-pyrazolyl)benzoic acid [2-(4-chloro-2-nitroanilino)-2-oxoethyl] ester

C20H17ClN4O5 (428.0887)

N-(4-bromo-2-methylphenyl)-4-[(1-methyl-2-oxo-4-quinolinyl)oxy]butanamide

C21H21BrN2O3 (428.0735)

N-(2,3-dimethylphenyl)-3-methyl-5-(4-morpholinylsulfonyl)-2-benzofurancarboxamide

C22H24N2O5S (428.1406)

4-Oxo-4-[5-(1,2,3,4-tetrahydronaphthalen-1-ylsulfamoyl)-2,3-dihydroindol-1-yl]butanoic acid

C22H24N2O5S (428.1406)

3-(1,3-Dioxo-2-isoindolyl)propanoic acid [4-[(4-methylanilino)-oxomethyl]phenyl] ester

C25H20N2O5 (428.1372)

3-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methoxy]-N,N-dimethyl-5-benzotriazolesulfonamide

C20H20N4O5S (428.1154)

[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone

C23H25FN2O3S (428.157)

1-[4-(Benzenesulfonyl)-1-piperazinyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone

C20H20N4O5S (428.1154)

N-(2,4-dimethylphenyl)-3-methyl-5-(4-morpholinylsulfonyl)-2-benzofurancarboxamide

C22H24N2O5S (428.1406)

2-[(3-acetyl-5-oxo-4H-imidazol-2-yl)thio]-N-(4-methyl-5-phenyl-2-thiazolyl)-N-prop-2-enylacetamide

C20H20N4O3S2 (428.0977)

1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[[2-(phenylmethyl)-4-quinazolinyl]thio]ethanone

C25H20N2O3S (428.1195)

N-cyclopropyl-N-[2-[(4-methoxyphenyl)methylamino]-2-oxo-1-thiophen-2-ylethyl]-4-thiadiazolecarboxamide

C20H20N4O3S2 (428.0977)

N-Methylnarceimicine

C22H22NO8+ (428.1345)

A natural product found in Corydalis saxicola.

(6S,7R,8R)-7-[4-[2-(4-fluorophenyl)ethynyl]phenyl]-8-(hydroxymethyl)-4-methylsulfonyl-1,4-diazabicyclo[4.2.0]octan-2-one

C22H21FN2O4S (428.1206)

(6S,7S,8R)-7-[4-[2-(4-fluorophenyl)ethynyl]phenyl]-8-(hydroxymethyl)-4-methylsulfonyl-1,4-diazabicyclo[4.2.0]octan-2-one

C22H21FN2O4S (428.1206)

(1R,9S,10S,11S)-12-(cyclopentanecarbonyl)-10-(hydroxymethyl)-6-oxo-N-(1,3-thiazol-2-yl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide

C21H24N4O4S (428.1518)

(1S,9R,10R,11R)-12-(cyclopentanecarbonyl)-10-(hydroxymethyl)-6-oxo-N-(1,3-thiazol-2-yl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide

C21H24N4O4S (428.1518)

(1R,5S)-N-(4-chlorophenyl)-7-[4-(4-cyanophenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane-6-carboxamide

C25H21ClN4O (428.1404)

(6S,7S,8S)-7-[4-[2-(4-fluorophenyl)ethynyl]phenyl]-8-(hydroxymethyl)-4-methylsulfonyl-1,4-diazabicyclo[4.2.0]octan-2-one

C22H21FN2O4S (428.1206)

(6R,7R,8S)-7-[4-[2-(4-fluorophenyl)ethynyl]phenyl]-8-(hydroxymethyl)-4-methylsulfonyl-1,4-diazabicyclo[4.2.0]octan-2-one

C22H21FN2O4S (428.1206)

(6R,7R,8R)-7-[4-[2-(4-fluorophenyl)ethynyl]phenyl]-8-(hydroxymethyl)-4-methylsulfonyl-1,4-diazabicyclo[4.2.0]octan-2-one

C22H21FN2O4S (428.1206)

6-[2-(Carboxymethyl)-3,5-dihydroxy-4-(3-methylbut-2-enyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C19H24O11 (428.1319)

6-[4-(Carboxymethyl)-3,5-dihydroxy-2-(3-methylbut-2-enyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C19H24O11 (428.1319)

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

C14H17N6O8P (428.0845)

12a-Hydroxydalpanol

C23H24O8 (428.1471)

1-(Methoxymethyl)-9a,11b-dimethyl-3,6,9-trioxo-1,6,6b,7,8,9,9a,10,11,11b-decahydro-3H-furo[4,3,2-de]indeno[4,5-h][2]benzopyran-11-yl acetate

C23H24O8 (428.1471)

Lacosamide-glucuronide

C18H24N2O10 (428.1431)

SB 243213

C22H19F3N4O2 (428.146)

ST 18:5;O7;S

C18H20O10S (428.0777)

ST 19:4;O6;S

C19H24O9S (428.1141)

ST 20:3;O5;S

C20H28O8S (428.1505)

Hydroxy ziprasidone

C21H21ClN4O2S (428.1074)

Hydroxy ziprasidone is an impurity of Ziprasidone[1]. Ziprasidone, an antipsychotic agent, is a combined 5-HT (serotonin) and dopamine receptor antagonist[2].

Valopicitabine (dihydrochloride)

C15H26Cl2N4O6 (428.1229)

Valopicitabine (NM283) dihydrochloride is a nucleoside analog and the orally bioavailable proagent of the potent anti-HCV agent 2'-C-methylcytidine (NM107). NM107competitively inhibits NS5B polymerase, causing chain termination[1][2].

4,5-dihydroxy-6-{[5-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-5,6-dihydro-4h-pyran-2-carboxylic acid

C21H16O10 (428.0743)

2-[4-(3,4-dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carbonyloxy]butanedioic acid

C21H16O10 (428.0743)

3,5,6-tris(acetyloxy)-9-oxoxanthen-1-yl acetate

C21H16O10 (428.0743)

(2s,3s)-2-benzoyl-1,3,8-trihydroxy-9-(4-methoxy-6-oxopyran-2-yl)-5-oxatricyclo[4.3.1.0³,⁸]decan-4-one

C22H20O9 (428.1107)

(1r,6r,13r)-13-hydroxy-6-(2-hydroxypropan-2-yl)-16,17-dimethoxy-2,7,20-trioxapentacyclo[11.8.0.0³,¹¹.0⁴,⁸.0¹⁴,¹⁹]henicosa-3,8,10,14(19),15,17-hexaen-12-one

C23H24O8 (428.1471)

2-methoxy-8-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one

C23H24O8 (428.1471)

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

C23H24O8 (428.1471)

(2r)-1-[(1s,2s)-2-[(s)-(acetyloxy)[(2r)-6-oxo-2,3-dihydropyran-2-yl]methyl]cyclopropyl]-1-oxopropan-2-yl (2z)-3-(4-hydroxyphenyl)prop-2-enoate

C23H24O8 (428.1471)

(1s,2s,3s,6s,8r,9s)-2-benzoyl-1,3,8-trihydroxy-9-(4-methoxy-6-oxopyran-2-yl)-5-oxatricyclo[4.3.1.0³,⁸]decan-4-one

C22H20O9 (428.1107)

methyl (1s,2r,4r)-2-ethyl-2,4,5,7,9-pentahydroxy-6,11-dioxo-3,4-dihydro-1h-tetracene-1-carboxylate

C22H20O9 (428.1107)

6-(benzoyloxy)-2-[(benzoyloxy)methyl]-2,3-dihydroxyhex-4-en-1-yl acetate

C23H24O8 (428.1471)

5,7-dihydroxy-2-[3-(2-hydroxy-3-methylbut-3-en-1-yl)-4-methoxyphenyl]-3,6-dimethoxychromen-4-one

C23H24O8 (428.1471)

(2s,3r,4r)-2,3,4-trihydroxy-5-{[4-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-5-methylidene-8h-naphthalen-2-yl]oxy}pentanal

C23H24O8 (428.1471)

4,12-bis(but-2-en-2-yl)-5-chloro-6-hydroxy-14-methoxy-7,15-dimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaen-10-one

C24H25ClO5 (428.139)

(10r,11r,15r)-8-methoxy-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1(9),2,7-trien-12-one

C23H24O8 (428.1471)

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

C22H20O9 (428.1107)

(2r)-2-[4-(3,4-dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carbonyloxy]butanedioic acid

C21H16O10 (428.0743)

3-{[(8s)-6,15,16-trimethoxy-12-oxo-11-oxa-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,9,13,15-heptaen-8-yl]sulfanyl}propanimidic acid

C21H20N2O6S (428.1042)

2-[(3,4-dihydroxy-5-{4-imino-3h,5h-pyrrolo[3,2-d]pyrimidin-7-yl}oxolan-2-yl)methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C17H24N4O9 (428.1543)

(2s,3s,6r,8s)-4-chloro-3-ethenyl-8-hydroxy-2-isothiocyanato-3,7,7,10-tetramethyl-10-azatetracyclo[6.6.1.1²,⁶.0¹¹,¹⁵]hexadeca-1(14),4,11(15),12-tetraene-9,16-dione

C22H21ClN2O3S (428.0961)

6-hydroxy-14-methoxy-10-oxo-12-(2-oxopentyl)-4-propyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylic acid

C23H24O8 (428.1471)

(4r)-4-[(s)-(7-methoxy-2h-1,3-benzodioxol-5-yl)(3,4,5-trimethoxyphenyl)methyl]-3-methylideneoxolan-2-one

C23H24O8 (428.1471)

5,7-dihydroxy-2-{3-[(2s)-2-hydroxy-3-methylbut-3-en-1-yl]-4-methoxyphenyl}-3,6-dimethoxychromen-4-one

C23H24O8 (428.1471)

3,7-dihydroxy-3'-(2-hydroxy-3-methyl-3-butenyl)-5,6,4'-trimethoxyflavone

C23H24O8 (428.1471)

{"Ingredient_id": "HBIN007773","Ingredient_name": "3,7-dihydroxy-3'-(2-hydroxy-3-methyl-3-butenyl)-5,6,4'-trimethoxyflavone","Alias": "NA","Ingredient_formula": "C23H24O8","Ingredient_Smile": "CC(=C)C(CC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)O)OC)OC)O)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5915","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

3-carboxy-6,7-dihydroxy-1-(3',4'-dihydroxy-phenyl)-naphthalene-9,2''-o-malicacid ester

C21H16O10 (428.0743)

{"Ingredient_id": "HBIN008377","Ingredient_name": "3-carboxy-6,7-dihydroxy-1-(3',4'-dihydroxy-phenyl)-naphthalene-9,2''-o-malicacid ester","Alias": "NA","Ingredient_formula": "C21H16O10","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3167","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

beta-peltatin a methyl ether

β-peltatin a methyl ether

C23H24O8 (428.1471)

{"Ingredient_id": "HBIN018226","Ingredient_name": "beta-peltatin a methyl ether","Alias": "\u03b2-peltatin a methyl ether","Ingredient_formula": "C23H24O8","Ingredient_Smile": "COC1=CC(=CC(=C1OC)OC)C2C3C(CC4=C(C5=C(C=C24)OCO5)OC)COC3=O","Ingredient_weight": "428.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "30332;16785","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "118701100","DrugBank_id": "NA"}