Exact Mass: 440.1089

Exact Mass Matches: 440.1089

Found 429 metabolites which its exact mass value is equals to given mass value 440.1089, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Ginkgolide C

8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,⁷.0⁷,¹¹.0¹³,¹⁷]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

Ginkgolide C is found in fats and oils. Ginkgolide C is a bitter principle from Ginkgo biloba (ginkgo). Bitter principle from Ginkgo biloba (ginkgo). Ginkgolide C is found in ginkgo nuts and fats and oils. Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease. Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease. Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease. Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease.

Hallactone B

C20H24O9S (440.1141)

A diterpenoid that is a organic heterohexacyclic compound consisting of lactone and epoxide ring systems. It is isolated from Podocarpus macrophyllus.

1S,3R-Rsl3

Methyl 2-(2-chloroacetyl)-1-(4-(methoxycarbonyl)phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate

C23H21ClN2O5 (440.1139)

S-[(Z)-N-hydroxy(4-hydroxyphenyl)acetimidoyl]glutathione

C18H24N4O7S (440.1366)

Aminopterin

2-[(4-{[(4-amino-2-imino-2,3-dihydropteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioate

C19H20N8O5 (440.1557)

Aminopterin Syndrome Sine Aminopterin (ASSA, OMIM 600325) is an embryopathy caused by maternal treatment with the olic acid antagonist aminopterin has been recognized since 1952 when aminopterin was used as an abortifacient. The characteristic phenotype of the children who survived infancy after having been exposed to aminopterin or its methyl derivative, methotrexate, in early pregnancy included a very unusual facies, skull anomalies, and skeletal defects.(OMIM). Aminopterin is an antimetabolite drug used in treatment of cancer and autoimmune diseases. It acts by inhibiting the metabolism of folic acid. - Wikipedia. The effects of the drug on intracellular metabolic processes, due to the inhibitory action on the enzyme dihydrofolate reductase, show that the result of this inhibition is more complex and is not limited to blockade of the reduction of folic acid alone. Although rescue methods are important in prevention of lethal effects of methotrexate, some metabolic pathways are insufficiently rescued, resulting in toxic reactions following methotrexate administration.(PMID 6398629). Aminopterin Syndrome Sine Aminopterin (ASSA, OMIM 600325) is an embryopathy caused by maternal treatment with the olic acid antagonist aminopterin has been recognized since 1952 when aminopterin was used as an abortifacient. The characteristic phenotype of the children who survived infancy after having been exposed to aminopterin or its methyl derivative, methotrexate, in early pregnancy included a very unusual facies, skull anomalies, and skeletal defects.(OMIM);

3,5-Dihydroxyphenyl 1-O-(6-O-galloyl-beta-D-glucopyranoside)

[6-(3,5-Dihydroxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoic acid

C19H20O12 (440.0955)

3,5-Dihydroxyphenyl 1-O-(6-O-galloyl-beta-D-glucopyranoside) is found in green vegetables. 3,5-Dihydroxyphenyl 1-O-(6-O-galloyl-beta-D-glucopyranoside) is isolated from commercial rhubarb (Rheum species). Isolated from commercial rhubarb (Rheum subspecies). 3,5-Dihydroxyphenyl 1-O-(6-O-galloyl-beta-D-glucopyranoside) is found in green vegetables.

Propylene glycol alginate

3-({3,4-dihydroxy-6-[(2-hydroxypropoxy)carbonyl]-5-methyloxan-2-yl}oxy)-4,5-dihydroxy-6-methoxyoxane-2-carboxylic acid

C17H28O13 (440.153)

Propylene glycol alginate is a stabiliser, emulsifier, thickener, formulation aid, surface active agent and flavouring adjunct or adjuvant for foodstuffs Propylene glycol alginate (PGA) is an emulsifier, stabilizer, and thickener used in food products. It is a food additive with E number E405. Chemically, propylene glycol alginate is an ester of alginic acid, which is derived from kelp. Some of the carboxyl groups are esterified with propylene glycol, some are neutralized with an appropriate alkali, and some remain free. Stabiliser, emulsifier, thickener, formulation aid, surface active agent and flavouring adjunct or adjuvant for foodstuffs

Isolariciresinol sulfate

{[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}sulphonic acid

C20H24O9S (440.1141)

Azobilirubin

4-(2-{5-[(3-ethenyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene)methyl]-4-methyl-3-propyl-1H-pyrrol-2-yl}diazen-1-yl)benzene-1-sulfonic acid

C22H24N4O4S (440.1518)

Butyrolactone derivative

Methyl 4-hydroxy-2-[(3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)methyl]-3-(4-hydroxyphenyl)-5-oxo-2,5-dihydrofuran-2-carboxylic acid

C24H24O8 (440.1471)

Ginkgolide

9H-1,7A-(EPOXYMETHANO)-1H,6AH-CYCLOPENTA(C)FURO(2,3-B)FURO(3,2:3,4)CYCLOPENTA(1,2-D)FURAN-5,9,12(4H)-TRIONE, 3-(1,1-DIMETHYLETHYL)HEXAHYDRO-2,4,7B,11-TETRAHYDROXY-8-METHYL-, (1S,2R,3S,3AS,4R,6AR,7AR,7BR,8S,10AS,11R,11AR)-

C20H24O11 (440.1319)

ginkgolide-C is a natural product found in Ginkgo biloba with data available. See also: Ginkgo (part of). Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease. Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease. Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease. Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease.

Combretastatin

C18H19O8P.2Na (440.0613)

Auranticin A

C24H24O8 (440.1471)

Pongamoside A

2- [ 3- (beta-D-Glucopyranosyloxy) phenyl ] -4H-furo [ 2,3-h ] -1-benzopyran-4-one

C23H20O9 (440.1107)

butyrolactone IV

(+)-Butyrolactone IV

C24H24O8 (440.1471)

A xanthone glycoside that is the 1,2,3,4-tetrahydro derivaive of swertianolin (the S,4R-stereoisomer). It is isolated from Swertia japonica and shows hepatoprotective properties.

Poliothyrsin

C20H24O11 (440.1319)

FL 120D

C22H20N2O8 (440.122)

Kopsinitarine D

C23H24N2O7 (440.1583)

Oximidine I

C23H24N2O7 (440.1583)

(+)-Mitorubrinol acetate

C23H20O9 (440.1107)

3,5,8-Trimethoxy-3,4-methylenedioxy-7-prenyloxyflavone

2- (1,3-Benzodioxol-5-yl) -3,5,8-trimethoxy-7- [ (3-methyl-2-butenyl) oxy ] -4H-1-benzopyran-4-one

C24H24O8 (440.1471)

6a,12b-Dihydro-3,10,11,12-tetrahydroxy-6-(3,4,5-trihydroxyphenyl)-[2]benzopyrano[3,4-c]benzopyran-8(6H)-one

6a,12b-Dihydro-3,10,11,12-tetrahydroxy-6- (3,4,5-trihydroxyphenyl) - [ 2 ] benzopyrano [ 3,4-c ] benzopyran-8 (6H) -one

C22H16O10 (440.0743)

Amurensisin

2-[(2R,3R)-3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-4,8,9,10-tetrahydroxy-6H-Dibenzo[b,d]pyran-6-one

C22H16O10 (440.0743)

8,9-Dimethoxy-2-(2-phenyldiazenyl)-3-(2-thienyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carbonitrile

C25H20N4O2S (440.1307)

ZINC1036431

C22H17ClN2O4S (440.0598)

Butyrolactone III

C24H24O8 (440.1471)

Hallacton B

C20H24O9S (440.1141)

(+)-isolarisiresinol 3alpha-O-sulphate

C20H24O9S (440.1141)

C23H24N2O7

C23H24N2O7 (440.1583)

C23H20O9

C23H20O9 (440.1107)

Plumenoside

C20H24O11 (440.1319)

butyrolactone V

C24H24O8 (440.1471)

amurenisin

C22H16O10 (440.0743)

NCGC00183926-01

C24H24O8 (440.1471)

10-O-(Z)-cinnamoyl-2-oxo-6-deoxyneoanisatin

C24H24O8 (440.1471)

(2R,3S,10S)-7,8,9,13-tetrahydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-trans-3,4-cis-2,3,10-trihydrobenzopyrano<3,4-c>-2-benzopyran-1-one|(2R,3S,10S)-7,8,9,13-tetrahydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-trans-3,4-cis-2,3,10-trihydrobenzopyrano[3,4-c]-2-benzopyran-1-one|(5鈥樎?Hydroxy-2R,3S,4S)-6-(3,4-Dihydroxyphenyl)-6alpha,12b-dihydro-3,10,11,12-tetrahydroxy[2]benzopyrano[3,4-c][1]benzopyran-8(6H)-one

(2R,3S,10S)-7,8,9,13-tetrahydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-trans-3,4-cis-2,3,10-trihydrobenzopyrano<3,4-c>-2-benzopyran-1-one|(2R,3S,10S)-7,8,9,13-tetrahydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-trans-3,4-cis-2,3,10-trihydrobenzopyrano[3,4-c]-2-benzopyran-1-one|(5鈥樎?Hydroxy-2R,3S,4S)-6-(3,4-Dihydroxyphenyl)-6alpha,12b-dihydro-3,10,11,12-tetrahydroxy[2]benzopyrano[3,4-c][1]benzopyran-8(6H)-one

C22H16O10 (440.0743)

3,5,8-Tri-Me,3,4-methylene ether,7-O-(3-methyl-2-butenyl)-Gossypetin

C24H24O8 (440.1471)

3,4-DihydrothonningineC

C24H24O8 (440.1471)

sulfatricalysine B

C16H24O12S (440.0988)

5-O-beta-D-glucopyranosyl-2,3-dihydrooroselol|peucedanoside B

C20H24O11 (440.1319)

3-O-(3,4-dihydroxy-trans-cinnamoyl)-4-O-malonyl-quinic acid

C19H20O12 (440.0955)

chlorotuberoside

C17H25ClO11 (440.1085)

Deoxyparguerol

C22H33BrO4 (440.1562)

ACon1_001794

C20H24O11 (440.1319)

(+)-mitorubrinol acetate|mitorubrinol acetate

C23H20O9 (440.1107)

makilalactone O

C20H24O9S (440.1141)

(2E)-3,4-dimethoxycinnamyl 3-(3,4-diacetoxyphenyl)acrylate

C24H24O8 (440.1471)

saliniquinone C

C23H17ClO7 (440.0663)

4-O-(E)-caffeoyl-5-O-malonylquinic acid|dihydroxy-5-carboxyacetoxy-4-[(E)-3-(3,4-dihydroxyphenyl)acryloyloxy]cyclohexanecarboxylic acid

C19H20O12 (440.0955)

3-O-malonyl-5-O-(E)-caffeoylquinic acid|dihydroxy-3-carboxyacetoxy-5-[(E)-3-(3,4-dihydroxyphenyl)acryloyloxy]cyclohexanecarboxylic acid

C19H20O12 (440.0955)

19,20-alpha-epoxy-12,15-dihydroxy-11-methoxyicajine

C23H24N2O7 (440.1583)

6-iodoaureol

C21H29IO2 (440.1212)

1-caffeoyl-6-tuliposide A|1-O-caffeoyl-6-O-(4-hydroxy-2-methylenebutyroyl)-beta-D-glucopyranose

C20H24O11 (440.1319)

ginkgolide Q

C20H24O11 (440.1319)

uvaridacol B

C24H24O8 (440.1471)

6?-O-feruloylgoodyeroside

C20H24O11 (440.1319)

(6-cis-p-coumaroyl)-3-O-beta-D-glucopyranosyl-2-deoxy-D-ribono-gamma-lactone

C20H24O11 (440.1319)

FL-120D

C22H20N2O8 (440.122)

duroin

C20H24O11 (440.1319)

artemicapin D

C22H16O10 (440.0743)

SCHEMBL17928282

C18H27Cl3N2O4 (440.1036)

Boletopsin B

C22H16O10 (440.0743)

2-O-acetyl-6-O-methylzeylenol

C24H24O8 (440.1471)

5,7,5-trimethoxy-6-(3-hydroxy-3-methyl-trans-but-1-enyl)-3,4-methylenedioxy flavone

C24H24O8 (440.1471)

Cortisonsulfat-Pyridiniumsalz

C21H28O8S (440.1505)

6295-09-6

C24H24O8 (440.1471)

1,6-di-O-cinnamoyl-beta-D-glucopyranoside

C24H24O8 (440.1471)

3,10-diacetoxy-1,2;8,9-diepoxy-2,3,6a,7,9,10,13a,14-octahydro-1H,8H-7a,14a-cyclo-pyrazino[1,2-a;4,5-a]diindole-6,13-dione|O,O-diacetyl-scabrosine|Scabrosin-4,4-diacetat

C22H20N2O8 (440.122)

dihydrodehydrodiconiferyl alcohol 9-O-sulfate

C20H24O9S (440.1141)

SCHEMBL2120361

C23H20O9 (440.1107)

O4-[O4,O6-((Xi)-1-Carboxy-aethyliden)-beta-D-galactopyranosyl]-3,6-anhydro-L-galactose-dimethylacetal|O4-[O4,O6-((Xi)-1-carboxy-ethylidene)-beta-D-galactopyranosyl]-3,6-anhydro-L-galactose-dimethylacetal

O4-[O4,O6-((Xi)-1-Carboxy-aethyliden)-beta-D-galactopyranosyl]-3,6-anhydro-L-galactose-dimethylacetal|O4-[O4,O6-((Xi)-1-carboxy-ethylidene)-beta-D-galactopyranosyl]-3,6-anhydro-L-galactose-dimethylacetal

C17H28O13 (440.153)

SCHEMBL11064691

C23H20O9 (440.1107)

3-O-(6-O-galloyl)-beta-D-glucopyranosylmaltol

C19H20O12 (440.0955)

epicoccin P

C19H24N2O6S2 (440.1076)

Antibiotic DC 44A

C23H20O9 (440.1107)

CHEMBL4206592

C27H20O6 (440.126)

JGB1741

C27H24N2O2S (440.1558)

JGB1741 (ILS-JGB-1741) is a potent and specific SIRT1 activity inhibitor with an IC50 of ～15 μM. JGB1741 is a weak SIRT2 and SIRT3 inhibitor with an all IC50>100 μM. JGB1741 increases the acetylated p53 levels leading to p53-mediated apoptosis with modulation of Bax/Bcl2 ratio, cytochrome c release and PARP cleavage. JGB1741 has the potential for breast cancer research[1].

CA 4P

Phenol, 2-methoxy-5-((1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl)-, 1-(dihydrogen phosphate), sodium salt (1:2)

C18H19Na2O8P (440.0613)

Fosbretabulin Disodium is the disodium salt of a water-soluble phosphate derivative of a natural stilbenoid phenol derived from the African bush willow (Combretum caffrum) with potential vascular disrupting and antineoplastic activities. Upon administration, the prodrug fosbretabulin is dephosphorylated to its active metabolite, the microtubule-depolymerizing agent combretastatin A4, which binds to tubulin dimers and prevents microtubule polymerization, resulting in mitotic arrest and apoptosis in endothelial cells. In addition, this agent disrupts the engagement of the endothelial cell-specific junctional molecule vascular endothelial-cadherin (VE-cadherin) and so the activity of the VE-cadherin/beta-catenin/Akt signaling pathway, which may result in the inhibition of endothelial cell migration and capillary tube formation. As a result of fosbretabulins dual mechanism of action, the tumor vasculature collapses, resulting in reduced tumor blood flow and ischemic necrosis of tumor tissue. Fosbretabulin disodium (CA 4DP) is a tubulin destabilizing agent. Fosbretabulin disodium is the Combretastatin A4 proagent that selectively targets endothelial cells, induces regression of nascent tumour neovessels, reduces tumour blood flow and causes central tumour necrosis[1][3].

MLS002695932-01!

C20H24O11 (440.1319)

(E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid

NCGC00380585-01!(E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid

C24H24O8 (440.1471)

methyl 2-[[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate

NCGC00179715-03!methyl 2-[[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

Aminopterin

2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid

C19H20N8O5 (440.1557)

C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite C471 - Enzyme Inhibitor > C2153 - Dihydrofolate Reductase Inhibitor D004791 - Enzyme Inhibitors > D005493 - Folic Acid Antagonists

methyl 2-[[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

(1S,3R,6R,7S,8S,9R,10S,13S,16S,17R)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,⁷.0⁷,¹¹.0¹³,¹⁷]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

Ginkgolide C

Ginkgolide C, analytical standard

C20H24O11 (440.1319)

Annotation level-1 Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease. Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease. Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease. Ginkgolide C is a flavone isolated from Ginkgo biloba leaves, possessing multiple biological functions, such as decreasing platelet aggregation and ameliorating Alzheimer disease.

(E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid [IIN-based on: CCMSLIB00000845225]

NCGC00380585-01!(E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid [IIN-based on: CCMSLIB00000845225]

C24H24O8 (440.1471)

(E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid [IIN-based: Match]

NCGC00380585-01!(E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid [IIN-based: Match]

C24H24O8 (440.1471)

methyl 2-[[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate [IIN-based on: CCMSLIB00000846943]

NCGC00179715-03!methyl 2-[[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate [IIN-based on: CCMSLIB00000846943]

C24H24O8 (440.1471)

methyl 2-[[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate [IIN-based: Match]

NCGC00179715-03!methyl 2-[[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate [IIN-based: Match]

C24H24O8 (440.1471)

methyl 2-[[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate [IIN-based on: CCMSLIB00000846940]

NCGC00179715-03!methyl 2-[[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate [IIN-based on: CCMSLIB00000846940]

C24H24O8 (440.1471)

(E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid [IIN-based on: CCMSLIB00000845223]

NCGC00380585-01!(E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid [IIN-based on: CCMSLIB00000845223]

C24H24O8 (440.1471)

methyl 2-[[3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl]methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate_major

C24H24O8 (440.1471)

(1S,3R,6R,7S,8S,9R,10S,13S,16S,17R)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,⁷.0⁷,¹¹.0¹³,¹⁷]nonadecane-5,15,18-trione_major

C20H24O11 (440.1319)

auranticin A_major

C24H24O8 (440.1471)

(1S,3R,6R,7S,8S,9R,10S,13S,16S,17R)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,?.0?,¹¹.0¹³,¹?]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

Cys Cys Cys Ile

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

C15H28N4O5S3 (440.1222)

Cys Cys Cys Leu

(2S)-2-[(2R)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-4-methylpentanoic acid

C15H28N4O5S3 (440.1222)

Cys Cys Asp Thr

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

C14H24N4O8S2 (440.1036)

Cys Cys Glu Ser

(4S)-4-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-4-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}butanoic acid

C14H24N4O8S2 (440.1036)

Cys Cys Ile Cys

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

C15H28N4O5S3 (440.1222)

Cys Cys Leu Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-4-methylpentanamido]-3-sulfanylpropanoic acid

C15H28N4O5S3 (440.1222)

Cys Cys Ser Glu

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

C14H24N4O8S2 (440.1036)

Cys Cys Thr Asp

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

C14H24N4O8S2 (440.1036)

Cys Asp Cys Thr

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

C14H24N4O8S2 (440.1036)

Cys Asp Phe Gly

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

C18H24N4O7S (440.1366)

Cys Asp Gly Phe

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

C18H24N4O7S (440.1366)

Cys Asp Thr Cys

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

C14H24N4O8S2 (440.1036)

Cys Glu Cys Ser

(4S)-4-[(2R)-2-amino-3-sulfanylpropanamido]-4-{[(1R)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

C14H24N4O8S2 (440.1036)

Cys Glu Ser Cys

(4S)-4-[(2R)-2-amino-3-sulfanylpropanamido]-4-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}butanoic acid

C14H24N4O8S2 (440.1036)

Cys Phe Asp Gly

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

C18H24N4O7S (440.1366)

Cys Phe Gly Asp

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

C18H24N4O7S (440.1366)

Cys Gly Asp Phe

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

C18H24N4O7S (440.1366)

Cys Gly Phe Asp

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

C18H24N4O7S (440.1366)

Cys Gly Met Met

(2S)-2-[(2S)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-4-(methylsulfanyl)butanamido]-4-(methylsulfanyl)butanoic acid

C15H28N4O5S3 (440.1222)

Cys Ile Cys Cys

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

C15H28N4O5S3 (440.1222)

Cys Leu Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-methylpentanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C15H28N4O5S3 (440.1222)

Cys Met Gly Met

(2S)-2-{2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]acetamido}-4-(methylsulfanyl)butanoic acid

C15H28N4O5S3 (440.1222)

Cys Met Met Gly

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

C15H28N4O5S3 (440.1222)

Cys Met Ser Thr

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

C15H28N4O7S2 (440.1399)

Cys Met Thr Ser

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

C15H28N4O7S2 (440.1399)

Cys Ser Cys Glu

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

C14H24N4O8S2 (440.1036)

Cys Ser Glu Cys

(4S)-4-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C14H24N4O8S2 (440.1036)

Cys Ser Met Thr

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

C15H28N4O7S2 (440.1399)

Cys Ser Thr Met

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

C15H28N4O7S2 (440.1399)

Cys Thr Cys Asp

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

C14H24N4O8S2 (440.1036)

Cys Thr Asp Cys

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

C14H24N4O8S2 (440.1036)

Cys Thr Met Ser

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

C15H28N4O7S2 (440.1399)

Cys Thr Ser Met

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

C15H28N4O7S2 (440.1399)

Asp Cys Cys Thr

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

C14H24N4O8S2 (440.1036)

Asp Cys Phe Gly

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

C18H24N4O7S (440.1366)

Asp Cys Gly Phe

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

C18H24N4O7S (440.1366)

Asp Cys Thr Cys

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

C14H24N4O8S2 (440.1036)

Asp Phe Cys Gly

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

C18H24N4O7S (440.1366)

Asp Phe Gly Cys

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

C18H24N4O7S (440.1366)

Asp Gly Cys Phe

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

C18H24N4O7S (440.1366)

Asp Gly Phe Cys

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

C18H24N4O7S (440.1366)

Asp Gly Ser Tyr

(3S)-3-amino-3-[({[(1S)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}methyl)carbamoyl]propanoic acid

C18H24N4O9 (440.1543)

Asp Gly Tyr Ser

(3S)-3-amino-3-[({[(1S)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}methyl)carbamoyl]propanoic acid

C18H24N4O9 (440.1543)

Asp Ser Gly Tyr

(3S)-3-amino-3-{[(1S)-1-[({[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}methyl)carbamoyl]-2-hydroxyethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Asp Ser Tyr Gly

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Asp Thr Cys Cys

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

C14H24N4O8S2 (440.1036)

Asp Tyr Gly Ser

(3S)-3-amino-3-{[(1S)-1-[({[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}methyl)carbamoyl]-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Asp Tyr Ser Gly

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-hydroxyethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Glu Cys Cys Ser

(4S)-4-amino-4-{[(1R)-1-{[(1R)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

C14H24N4O8S2 (440.1036)

Glu Cys Ser Cys

(4S)-4-amino-4-{[(1R)-1-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

C14H24N4O8S2 (440.1036)

Glu Ser Cys Cys

(4S)-4-amino-4-{[(1S)-1-{[(1R)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}butanoic acid

C14H24N4O8S2 (440.1036)

Phe Cys Asp Gly

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

C18H24N4O7S (440.1366)

Phe Cys Gly Asp

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

C18H24N4O7S (440.1366)

Phe Asp Cys Gly

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

C18H24N4O7S (440.1366)

Phe Asp Gly Cys

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

C18H24N4O7S (440.1366)

Phe Gly Cys Asp

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

C18H24N4O7S (440.1366)

Phe Gly Asp Cys

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

C18H24N4O7S (440.1366)

Gly Cys Asp Phe

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

C18H24N4O7S (440.1366)

Gly Cys Phe Asp

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

C18H24N4O7S (440.1366)

Gly Cys Met Met

(2S)-2-[(2S)-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-4-(methylsulfanyl)butanoic acid

C15H28N4O5S3 (440.1222)

Gly Asp Cys Phe

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

C18H24N4O7S (440.1366)

Gly Asp Phe Cys

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

C18H24N4O7S (440.1366)

Gly Asp Ser Tyr

(3S)-3-(2-aminoacetamido)-3-{[(1S)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Gly Asp Tyr Ser

(3S)-3-(2-aminoacetamido)-3-{[(1S)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Gly Phe Cys Asp

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

C18H24N4O7S (440.1366)

Gly Phe Asp Cys

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

C18H24N4O7S (440.1366)

Gly Met Cys Met

(2S)-2-[(2R)-2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanoic acid

C15H28N4O5S3 (440.1222)

Gly Met Met Cys

(2R)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanoic acid

C15H28N4O5S3 (440.1222)

Gly Ser Asp Tyr

(3S)-3-[(2S)-2-(2-aminoacetamido)-3-hydroxypropanamido]-3-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Gly Ser Tyr Asp

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

C18H24N4O9 (440.1543)

Gly Tyr Asp Ser

(3S)-3-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanamido]-3-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Gly Tyr Ser Asp

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

C18H24N4O9 (440.1543)

Ile Cys Cys Cys

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

C15H28N4O5S3 (440.1222)

Leu Cys Cys Cys

(2R)-2-[(2R)-2-[(2R)-2-[(2S)-2-amino-4-methylpentanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C15H28N4O5S3 (440.1222)

Met Cys Gly Met

(2S)-2-{2-[(2R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]acetamido}-4-(methylsulfanyl)butanoic acid

C15H28N4O5S3 (440.1222)

Met Cys Met Gly

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

C15H28N4O5S3 (440.1222)

Met Cys Ser Thr

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

C15H28N4O7S2 (440.1399)

Met Cys Thr Ser

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

C15H28N4O7S2 (440.1399)

Met Gly Cys Met

(2S)-2-[(2R)-2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-3-sulfanylpropanamido]-4-(methylsulfanyl)butanoic acid

C15H28N4O5S3 (440.1222)

Met Gly Met Cys

(2R)-2-[(2S)-2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-4-(methylsulfanyl)butanamido]-3-sulfanylpropanoic acid

C15H28N4O5S3 (440.1222)

Met Met Cys Gly

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

C15H28N4O5S3 (440.1222)

Met Met Gly Cys

(2R)-2-{2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-(methylsulfanyl)butanamido]acetamido}-3-sulfanylpropanoic acid

C15H28N4O5S3 (440.1222)

Met Ser Cys Thr

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

C15H28N4O7S2 (440.1399)

Met Ser Thr Cys

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

C15H28N4O7S2 (440.1399)

Met Thr Cys Ser

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

C15H28N4O7S2 (440.1399)

Met Thr Ser Cys

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

C15H28N4O7S2 (440.1399)

Ser Cys Cys Glu

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

C14H24N4O8S2 (440.1036)

Ser Cys Glu Cys

(4S)-4-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C14H24N4O8S2 (440.1036)

Ser Cys Met Thr

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

C15H28N4O7S2 (440.1399)

Ser Cys Thr Met

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

C15H28N4O7S2 (440.1399)

Ser Asp Gly Tyr

(3S)-3-[(2S)-2-amino-3-hydroxypropanamido]-3-[({[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}methyl)carbamoyl]propanoic acid

C18H24N4O9 (440.1543)

Ser Asp Tyr Gly

(3S)-3-[(2S)-2-amino-3-hydroxypropanamido]-3-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Ser Glu Cys Cys

(4S)-4-[(2S)-2-amino-3-hydroxypropanamido]-4-{[(1R)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

C14H24N4O8S2 (440.1036)

Ser Gly Asp Tyr

(3S)-3-{2-[(2S)-2-amino-3-hydroxypropanamido]acetamido}-3-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Ser Gly Tyr Asp

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

C18H24N4O9 (440.1543)

Ser Met Cys Thr

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

C15H28N4O7S2 (440.1399)

Ser Met Thr Cys

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

C15H28N4O7S2 (440.1399)

Ser Thr Cys Met

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

C15H28N4O7S2 (440.1399)

Ser Thr Met Cys

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

C15H28N4O7S2 (440.1399)

Ser Tyr Asp Gly

(3S)-3-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-[(carboxymethyl)carbamoyl]propanoic acid

C18H24N4O9 (440.1543)

Ser Tyr Gly Asp

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

C18H24N4O9 (440.1543)

Thr Cys Cys Asp

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

C14H24N4O8S2 (440.1036)

Thr Cys Asp Cys

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

C14H24N4O8S2 (440.1036)

Thr Cys Met Ser

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

C15H28N4O7S2 (440.1399)

Thr Cys Ser Met

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

C15H28N4O7S2 (440.1399)

Thr Asp Cys Cys

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

C14H24N4O8S2 (440.1036)

Thr Met Cys Ser

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

C15H28N4O7S2 (440.1399)

Thr Met Ser Cys

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

C15H28N4O7S2 (440.1399)

Thr Ser Cys Met

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

C15H28N4O7S2 (440.1399)

Thr Ser Met Cys

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

C15H28N4O7S2 (440.1399)

Tyr Asp Gly Ser

(3S)-3-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-[({[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}methyl)carbamoyl]propanoic acid

C18H24N4O9 (440.1543)

Tyr Asp Ser Gly

(3S)-3-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-hydroxyethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Tyr Gly Asp Ser

(3S)-3-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}-3-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propanoic acid

C18H24N4O9 (440.1543)

Tyr Gly Ser Asp

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

C18H24N4O9 (440.1543)

Tyr Ser Asp Gly

(3S)-3-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-3-[(carboxymethyl)carbamoyl]propanoic acid

C18H24N4O9 (440.1543)

Tyr Ser Gly Asp

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

C18H24N4O9 (440.1543)

(-)-Amurensisin

C22H16O10 (440.0743)

His-Tyr-OH

(S)-2-(3-(2-(1H-imidazol-4-yl)ethoxy)-4-nitrobenzamido)-3-(4-hydroxyphenyl)propanoic acid

C21H20N4O7 (440.1332)

Tyr-His-OH

(S)-2-(3-(4-hydroxyphenethoxy)-4-nitrobenzamido)-4-(1H-imidazol-4-yl)butanoic acid

C21H20N4O7 (440.1332)

Trp-Asn-OH

(S)-2-(3-(2-(1H-indol-3-yl)ethoxy)-4-nitrobenzamido)-5-amino-5-oxopentanoic acid

C21H20N4O7 (440.1332)

3,5-Dihydroxyphenyl 1-O-(6-O-galloyl-b-D-glucopyranoside)

[6-(3,5-dihydroxyphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate

C19H20O12 (440.0955)

Dricoid

3-({3,4-dihydroxy-6-[(2-hydroxypropoxy)carbonyl]-5-methyloxan-2-yl}oxy)-4,5-dihydroxy-6-methoxyoxane-2-carboxylic acid

C17H28O13 (440.153)

9,10-dibromo-stearic acid

9,10-dibromo-octadecanoic acid

C18H34Br2O2 (440.0925)

b-D-Glucopyranoside, phenyl1-thio-, 2,3,4,6-tetraacetate

C20H24O9S (440.1141)

(Boc-Cys-OH)2

C16H28N2O8S2 (440.1287)

Zincon monosodium salt

C20H16N4O6S (440.0791)

(4-CHLOROBENZYL)TRIPHEYLPHOSPHONIUM TETRAFLUOROBORATE

C25H22BF4P (440.1488)

(4R)-5-(8-azaspiro[4.5]decan-8-yl)-4-[(3,5-dichlorobenzoyl)amino]-5-oxopentanoic acid

C21H26Cl2N2O4 (440.127)

4-[[4-(aminocarbonyl)phenyl]azo]-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide

C25H20N4O4 (440.1484)

(+)-(18-crown-6)-2,3,11,12-tetracarboxylic acid

C16H24O14 (440.1166)

2-((4-METHOXYPHENYL)AMINO)-1-(2-(TRIFLUOROMETHYL)BENZYL)-1H-BENZO[D]IMIDAZOLE-5-CARBOXAMIDE

C23H19F3N4O2 (440.146)

1,4-bis(4-phenylphenyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-3,6-dione

C30H20N2O2 (440.1525)

3-hydroxy-4-[(2-methyl-5-nitrophenyl)azo]-N-(o-tolyl)naphthalene-2-carboxamide

C25H20N4O4 (440.1484)

Phenyl 2,3,4,6-Tetra-O-acetyl-1-thio-a-D-mannopyranoside

C20H24O9S (440.1141)

(S)-(-)-1,1-BINAPHTHYL-2,2-DIAMINE

C24H24O6S (440.1294)

Cefsumide

C17H20N4O6S2 (440.0824)

FLUORESCEIN O O-DIACRYLATE

C26H16O7 (440.0896)

sodium 2-hydroxy-3-[3-[1,3,3,3-tetramethyl-1-[(trimethylsilyl)oxy]disiloxanyl]propoxy]propane-1-sulphonate

C13H33NaO7SSi3 (440.1152)

metamifop

Metamifop [ISO]

C23H18ClFN2O4 (440.0939)

phenyl 2,3,4,6-tetra-o-acetyl-1-thio-beta-d-galactopyranoside

C20H24O9S (440.1141)

Pigment Red 13

C25H20N4O4 (440.1484)

(R)-(+)-1,2-EPOXYPENTADECANE

C24H24O6S (440.1294)

1-[(4-chlorophenyl)-phenylmethyl]-4-(4-methylphenyl)sulfonylpiperazine

C24H25ClN2O2S (440.1325)

(3β)-17-Iodoandrosta-5,16-dien-3-yl acetate

C21H29IO2 (440.1212)

Benzonitrile, 4-[4-[[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]-1-piperazinyl]-

C22H18Cl2N4O2 (440.0807)

1-METHYL-3-TRIFLUOROMETHYL-5-TRIBUTYLSTANNYLPYRAZOLE

C17H31F3N2Sn (440.1461)

4-SULFOCALIX[4]ARENE

C28H24O3S (440.1446)

4-Thiazolidinecarboxylic acid, 3-[[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]acetyl]-2,2-dimethyl-, (4R)-

C23H24N2O5S (440.1406)

Ravoxertinib

C21H18ClFN6O2 (440.1164)

C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C174048 - ERK Inhibitor D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors D000970 - Antineoplastic Agents Ravoxertinib (GDC-0994) is an orally active ERK kinase inhibitor with an IC50 of 6.1 nM and 3.1 nM for ERK1 and ERK2, respectively.

(-)-(18-CROWN-6)-2 3 11 12-TETRACARBOXY&

C16H24O14 (440.1166)

Triphenylbismuth

C18H15Bi (440.0978)

9,10-DIBROMOSTEARIC ACID

9,10-Dibromooctadecanoic acid

C18H34Br2O2 (440.0925)

Pigment Red 12

C25H20N4O4 (440.1484)

Zincon

C20H16N4O6S (440.0791)

3-(N-Morpholino)propanesulfonic acid hemisodium salt

C14H29N2NaO8S2 (440.1263)

BIS[BIS(TRIMETHYLSILYL)AMINO]TIN II

C12H36N2Si4Sn (440.0977)

Heptyl(triphenyl)phosphonium bromide

C25H30BrP (440.1268)

C21H20N4O5S

C21H20N4O5S (440.1154)

Bis(indenyl)dimethylhafnium(IV)

(C9H7)2Hf(CH3)2 (440.1031)

GSK 2018682

4-(4-(5-(5-chloro-6-isopropoxypyridin-3-yl)-1,2,4-oxadiazol-3-yl)-1H-indol-1-yl)butanoic acid

C22H21ClN4O4 (440.1251)

(S)-2-[(4-nitro-phenoxy)-phenoxy-phosphorylamino]propionic acid isopropyl ester

C18H21N2O9P (440.0985)

N-(5-METHYLISOXAZOL-3-YL)-4-(3-(3-(TRIFLUOROMETHYL)PHENYL)UREIDO)BENZENESULFONAMIDE

C18H15F3N4O4S (440.0766)

(4Z)-4-[(5-carbamoyl-2-methoxyphenyl)hydrazinylidene]-3-oxo-N-phenylnaphthalene-2-carboxamide

C25H20N4O4 (440.1484)

tributyltin trifluoromethanesulfonate

C13H27F3O3SSn (440.0655)

(4Z)-4-[[2-methoxy-5-(phenylcarbamoyl)phenyl]hydrazinylidene]-3-oxonaphthalene-2-carboxamide

C25H20N4O4 (440.1484)

cerium(4+),2-methoxyethanolate

C12H28CeO8 (440.0839)

(r)-(2-Chloro-3-(trifluoromethyl)phenyl)(1-(5-fluoropyrimidin-2-yl)-4-methyl-1,4,6,7-tetrahydro-5h-[1,2,3]triazolo[4,5-c]pyridin-5-yl)methanone

C18H13ClF4N6O (440.0775)

1-(2,4-dichlorophenyl)-6-methyl-N-(1-piperidinyl)-4H-indeno[1,2-c]pyrazole-3-carboxamide

C23H22Cl2N4O (440.1171)

1R,3S-Rsl 3

C23H21ClN2O5 (440.1139)

2-Benzofurancarboxylic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

C25H16N2O4S (440.0831)

2-oxo-N-[2-[(2-phenyl-1H-indol-3-yl)thio]ethyl]-1-benzopyran-3-carboxamide

C26H20N2O3S (440.1195)

2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-N-(2-furanylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

C23H24N2O5S (440.1406)

3-{2,6,8-Trioxo-9-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-1,2,3,6,8,9-hexahydro-7H-purin-7-YL}propyl dihydrogen phosphate

C13H21N4O11P (440.0944)

(2R,3R,4S,5R)-2-[6-amino-8-[(3,4-dichlorophenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

C17H18Cl2N6O4 (440.0767)

N2-({[(4-Bromophenyl)methyl]oxy}carbonyl)-N1-[(1S)-1-formylpentyl]-L-leucinamide

C20H29BrN2O4 (440.1311)

3-{2,6,8-Trioxo-9-[(2R,3S,4R)-2,3,4,5-tetrahydroxypentyl]-1,2,3,6,8,9-hexahydro-7H-purin-7-YL}propyl dihydrogen phosphate

C13H21N4O11P (440.0944)

3-{2,6,8-Trioxo-9-[(2S,3R,4R)-2,3,4,5-tetrahydroxypentyl]-1,2,3,6,8,9-hexahydro-7H-purin-7-YL}propyl dihydrogen phosphate

C13H21N4O11P (440.0944)

3-{2,6,8-Trioxo-9-[(2R,3R,4R)-2,3,4,5-tetrahydroxypentyl]-1,2,3,6,8,9-hexahydro-7H-purin-7-YL}propyl dihydrogen phosphate

C13H21N4O11P (440.0944)

Fosbretabulin disodium

Combretastatin A4 disodium phosphate

C18H19Na2O8P (440.0613)

C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent D000970 - Antineoplastic Agents Fosbretabulin disodium (CA 4DP) is a tubulin destabilizing agent. Fosbretabulin disodium is the Combretastatin A4 proagent that selectively targets endothelial cells, induces regression of nascent tumour neovessels, reduces tumour blood flow and causes central tumour necrosis[1][3].

S-D-mandeloylglutathione

C18H22N3O8S- (440.1128)

N,N-diacetyl-thiochitobiose

C16H28N2O10S (440.1465)

(2S)-2-amino-5-[[(1R)-1-carboxy-2-[(1,2,6-trimethyl-3,5-dioxopyrazolo[1,2-a]pyrazol-7-yl)methylsulfanyl]ethyl]amino]-5-oxopentanoic acid

C18H24N4O7S (440.1366)

4-[[5-[(Z)-(3-ethenyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-4-methyl-3-propyl-1H-pyrrol-2-yl]diazenyl]benzenesulfonic acid

C22H24N4O4S (440.1518)

3-(2-chlorophenyl)-6-(3-cyclopentyloxy-4-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

C22H21ClN4O2S (440.1074)

3-[4-[(5Z)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid

C22H20N2O4S2 (440.0864)

CID 11826309

C20H24O11 (440.1319)

6-[[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)anilino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid

C23H24N2O5S (440.1406)

2,6-difluoro-N-[2-[3-[(2-fluorophenyl)methylthio]-1-indolyl]ethyl]benzamide

C24H19F3N2OS (440.117)

4,5-Dimethoxy-2-[[1-oxo-2-[(3,5,8-trimethyl-2-quinolinyl)thio]ethyl]amino]benzoic acid

C23H24N2O5S (440.1406)

2-(3,5-Dinitrophenyl)-3-(2-phenylethyl)imidazo[4,5-b]quinoxaline

C23H16N6O4 (440.1233)

2-[N-(benzenesulfonyl)-4-ethoxyanilino]-N-(2-methoxyphenyl)acetamide

C23H24N2O5S (440.1406)

2-[[4-(2,5-dimethylphenyl)-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide

C20H20N6O2S2 (440.1089)

(1S,5R)-3-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

C23H21ClN2O5 (440.1139)

(1R,9S,10S,11S)-5-(3-fluorophenyl)-10-(hydroxymethyl)-12-methyl-6-oxo-N-(1,3-thiazol-2-yl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide

C22H21FN4O3S (440.1318)

(1S,9R,10R,11R)-5-(3-fluorophenyl)-10-(hydroxymethyl)-12-methyl-6-oxo-N-(1,3-thiazol-2-yl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide

C22H21FN4O3S (440.1318)

3-chloro-N-[(2S,3R,6S)-6-[2-(ethylsulfonylamino)ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide

C16H25ClN2O6S2 (440.0842)

3-chloro-N-[(2R,3R,6S)-6-[2-(ethylsulfonylamino)ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide

C16H25ClN2O6S2 (440.0842)

3-chloro-N-[(2R,3S,6R)-6-[2-(ethylsulfonylamino)ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide

C16H25ClN2O6S2 (440.0842)

3-chloro-N-[(2S,3S,6R)-6-[2-(ethylsulfonylamino)ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide

C16H25ClN2O6S2 (440.0842)

3-chloro-N-[(2R,3S,6S)-6-[2-(ethylsulfonylamino)ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide

C16H25ClN2O6S2 (440.0842)

[8-(2-hydroxy-1-sulooxypropan-2-yl)-2-oxo-8,9-dihydrouro[2,3-h]chromen-9-yl] (E)-2-methylbut-2-enoate

C19H20O10S (440.0777)

(2-hydroxy-2-{9-[(3-methylbut-2-enoyl)oxy]-2-oxo-2H,8H,9H-furo[2,3-h]chromen-8-yl}propoxy)sulfonic acid

C19H20O10S (440.0777)

(2-{9-hydroxy-2-oxo-2H,8H,9H-furo[2,3-h]chromen-8-yl}-2-[(3-methylbut-2-enoyl)oxy]propoxy)sulfonic acid

C19H20O10S (440.0777)

(1R,3R,8S,9R,10S,13S,16S,17R)-8-Tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

2-amino-5-[[3-[(Z)-C-benzyl-N-hydroxycarbonimidoyl]sulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

C18H24N4O7S (440.1366)

(1S,3R,6R,7S,8S,9R,10S,11R,12S,13S,16S,17R)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

(1S,3R,6R,7S,8S,9R,10S,13S,16S,17R)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0(1),(1)(1).0(3),.0,(1)(1).0(1)(3),(1)]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

(1R,6R,7S,8S,9S,10S,11R,12R,13S,16S,17R)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

(1S,3R,6R,7S,8S,9R,10S,11R,13S,16S,17R)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

(1R,6R,7R,8S,9S,10S,11R,12R,13S,16S,17R)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.01,11.03,7.07,11.013,17]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

3,5-Dihydroxyphenyl 1-O-(6-O-galloyl-beta-D-glucopyranoside)

C19H20O12 (440.0955)

(1R,3S)-2-(2-chloro-1-oxoethyl)-1-(4-methoxycarbonylphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid methyl ester

C23H21ClN2O5 (440.1139)

LSM-16753

C23H21ClN2O5 (440.1139)

Dibromostearic acid

C18H34Br2O2 (440.0925)

Aminofolic acid

C19H20N8O5 (440.1557)

12a-Hydroxyerythynone

C24H24O8 (440.1471)

Hydroxyerythynone

C24H24O8 (440.1471)

ST 20:5;O6;S

C20H24O9S (440.1141)

ST 21:4;O5;S

C21H28O8S (440.1505)

(E/Z)-ZINC09659342

C23H15F3N2O4 (440.0984)

(E/Z)-ZINC09659342 is an inhibitor of Lbc-RhoA interaction[1].

AZD4747

C24H22ClFN2O3 (440.1303)

AZD4747 is a selective, blood-brain barrier-permeable mutant GTPase KRASG12C inhibitor. AZD4747 has the potential to study cancer[1].

JP1302 dihydrochloride

C24H26Cl2N4 (440.1534)

JP1302 dihydrochloride is a potent, selective, high affinity antagonist of the α2C-adrenoceptor, with a Kb of 16 nM and a Ki of 28 nM for the human α2C-receptor. JP1302 dihydrochloride shows antidepressant and antipsychotic-like effects. JP1302 dihydrochloride can be used for neuropsychiatric disorders and renal dysfunction research[1][2][3].

PF-06372865

C22H21FN4O3S (440.1318)

PF-06372865 is an orally active, α2/α3/α5 subtype-selective GABAA positive allosteric modulator (PAM). PF-06372865 is a high affinity ligand at GABAA receptors containing α1/α2/α3/α5 subunits (Kis of 2.9 nM, 21 nM, 134 nM for α2, α1 PAM, α2 PAM, respectively), with low affinity for α4/α6 subunits. PF-06372865 can across the blood-brain barrier (BBB). PF-06372865 has anxiolytic activity and has the potential for epilepsy[1].

methyl (1r,2r,4r,5r,7r,11s,12s,15s,23r)-4,11-dihydroxy-18-methoxy-3-oxo-6-oxa-8,16-diazaoctacyclo[10.10.1.0¹,¹⁵.0²,⁷.0⁴,¹⁵.0⁵,¹².0⁸,²³.0¹⁷,²²]tricosa-17,19,21-triene-16-carboxylate

methyl (1r,2r,4r,5r,7r,11s,12s,15s,23r)-4,11-dihydroxy-18-methoxy-3-oxo-6-oxa-8,16-diazaoctacyclo[10.10.1.0¹,¹⁵.0²,⁷.0⁴,¹⁵.0⁵,¹².0⁸,²³.0¹⁷,²²]tricosa-17,19,21-triene-16-carboxylate

C23H24N2O7 (440.1583)

methyl (1r,2r,4s,5r,7r,11s,12s,15s,23r)-4,11-dihydroxy-18-methoxy-3-oxo-6-oxa-8,16-diazaoctacyclo[10.10.1.0¹,¹⁵.0²,⁷.0⁴,¹⁵.0⁵,¹².0⁸,²³.0¹⁷,²²]tricosa-17,19,21-triene-16-carboxylate

methyl (1r,2r,4s,5r,7r,11s,12s,15s,23r)-4,11-dihydroxy-18-methoxy-3-oxo-6-oxa-8,16-diazaoctacyclo[10.10.1.0¹,¹⁵.0²,⁷.0⁴,¹⁵.0⁵,¹².0⁸,²³.0¹⁷,²²]tricosa-17,19,21-triene-16-carboxylate

C23H24N2O7 (440.1583)

methyl (2r)-2-[(3-{[(2r)-3,3-dimethyloxiran-2-yl]methyl}-4-hydroxyphenyl)methyl]-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

(1r,3r,9r,10s,13s,16s,17r)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,⁷.0⁷,¹¹.0¹³,¹⁷]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

(e,2z,4e)-n-[(1z)-3-[(4s,5r,6s,8r,9z,11e)-5,17-dihydroxy-2-oxo-3,7-dioxatricyclo[11.4.0.0⁶,⁸]heptadeca-1(17),9,11,13,15-pentaen-4-yl]prop-1-en-1-yl]-4-(methoxyimino)but-2-enimidic acid

C23H24N2O7 (440.1583)

4,17,19-trihydroxy-4-(methoxycarbonyl)-11-methyl-2,13-dioxo-12-oxa-6-thiatricyclo[13.4.0.0³,⁷]nonadeca-1(19),15,17-trien-6-ium-6-olate

C20H24O9S (440.1141)

(11s)-4,17,19-trihydroxy-4-(methoxycarbonyl)-11-methyl-2,13-dioxo-12-oxa-6-thiatricyclo[13.4.0.0³,⁷]nonadeca-1(19),15,17-trien-6-ium-6-olate

C20H24O9S (440.1141)

methyl (2r)-4-hydroxy-3-(4-hydroxyphenyl)-2-{[(2r)-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]methyl}-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

amurenisin

C22H16O10 (440.0743)

{"Ingredient_id": "HBIN015915","Ingredient_name": "amurenisin","Alias": "NA","Ingredient_formula": "C22H16O10","Ingredient_Smile": "C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C4C(=C3)C5=C(C(=C(C=C5C(=O)O4)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1090","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

n-(3-{5,17-dihydroxy-2-oxo-3,7-dioxatricyclo[11.4.0.0⁶,⁸]heptadeca-1(17),9,11,13,15-pentaen-4-yl}prop-2-en-1-yl)-4-(methoxyimino)but-2-enimidic acid

C23H24N2O7 (440.1583)

(1s,2r,4s,5r,10s,11r,13s,15s,18r)-5-[(2s)-2-hydroxy-1-methanesulfonylpropan-2-yl]-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

C20H24O9S (440.1141)

(1s,3r,4r,5r)-4-[(2-carboxyacetyl)oxy]-3-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,5-dihydroxycyclohexane-1-carboxylic acid

C19H20O12 (440.0955)

(1s,2r,4s,5r,10s,11s,13r,14r,15r,18r)-14-hydroxy-5-[(2r)-2-hydroxy-1-methanesulfinylpropan-2-yl]-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

(1s,2r,4s,5r,10s,11s,13r,14r,15r,18r)-14-hydroxy-5-[(2r)-2-hydroxy-1-methanesulfinylpropan-2-yl]-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

C20H24O9S (440.1141)

(1s,3r,4r,5r)-3-[(2-carboxyacetyl)oxy]-5-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4-dihydroxycyclohexane-1-carboxylic acid

C19H20O12 (440.0955)

(1s,2r,4s,5r,10s,11s,13r,14r,15r,18r)-14-hydroxy-5-[(2r)-2-hydroxy-1-[(s)-methanesulfinyl]propan-2-yl]-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

(1s,2r,4s,5r,10s,11s,13r,14r,15r,18r)-14-hydroxy-5-[(2r)-2-hydroxy-1-[(s)-methanesulfinyl]propan-2-yl]-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

C20H24O9S (440.1141)

(1r,2s,4r,6r)-14-hydroxy-10-methoxy-4,12-dimethyl-6-{[(2s)-5-oxooxolan-2-yl]methyl}-5,7,17-trioxapentacyclo[9.6.2.0²,⁶.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-8(18),9,11,13,15(19)-pentaen-16-one

C24H24O8 (440.1471)

methyl 6-chloro-5,7-dihydroxy-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-4-carboxylate

C17H25ClO11 (440.1085)

5,24-dimethoxy-7,9,12,17,20,22-hexaoxaheptacyclo[13.11.0.0²,¹⁴.0³,¹¹.0⁶,¹⁰.0¹⁸,²⁶.0¹⁹,²³]hexacosa-3(11),4,6(10),18(26),19(23),24-hexaene-13,16-dione

C22H16O10 (440.0743)

2-[(2s)-3-chloro-2-hydroxypent-4-en-2-yl]-11-hydroxy-5-(hydroxymethyl)-1-oxatetraphene-4,7,12-trione

C23H17ClO7 (440.0663)

methyl (2r)-4-hydroxy-3-(4-hydroxyphenyl)-2-{[(2r)-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-6-yl]methyl}-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

4,8,9,10-tetrahydroxy-2-(3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)benzo[c]chromen-6-one

C22H16O10 (440.0743)

(1s,4s,8r,10s,11r,14s)-11-acetyl-5-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7,9,13-trioxatetracyclo[6.5.1.0¹,¹⁰.0⁴,¹⁴]tetradeca-2,5-dien-12-one

C20H24O11 (440.1319)

(1s,3r,4r,5r)-3-[(2-carboxyacetyl)oxy]-5-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4-dihydroxycyclohexane-1-carboxylic acid

C19H20O12 (440.0955)

(1ar,1br,3r,3ar,5s,7br,9r,9ar)-5-[(1s)-1-bromo-2-hydroxyethyl]-3-hydroxy-1a,5,7b-trimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-9-yl acetate

C22H33BrO4 (440.1562)

9-hydroxy-8-(2-hydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-8h,9h-furo[2,3-h]chromen-2-one

C20H24O11 (440.1319)

(1s,2r,3s,4r)-5-cyano-1,2,3,7-tetrahydroxy-3-methyl-6,11-dioxo-1h,2h,4h-benzo[b]carbazol-4-yl 2-methylpropanoate

C22H20N2O8 (440.122)

(5-hydroxy-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate

C20H24O11 (440.1319)

(1s,4s,8r,10r,11r,14s)-11-acetyl-5-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7,9,13-trioxatetracyclo[6.5.1.0¹,¹⁰.0⁴,¹⁴]tetradeca-2,5-dien-12-one

C20H24O11 (440.1319)

2-(2h-1,3-benzodioxol-5-yl)-3,5,8-trimethoxy-7-[(3-methylbut-2-en-1-yl)oxy]chromen-4-one

C24H24O8 (440.1471)

3,8,15,20-tetraoxatricyclo[20.2.2.2¹⁰,¹³]octacosa-1(24),10,12,22,25,27-hexaene-2,9,14,21-tetrone

C24H24O8 (440.1471)

methyl 4-hydroxy-3-(4-hydroxyphenyl)-2-{[2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-6-yl]methyl}-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

(3ar,4s,9as)-4-[4-(acetyloxy)-3-methoxyphenyl]-7-methoxy-1-oxo-3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan-6-yl acetate

C24H24O8 (440.1471)

3-[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]propoxysulfonic acid

C20H24O9S (440.1141)

[(2r,3s,4r,5r,6r)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(3,4,5-trimethoxyphenyl)methoxy]oxan-3-yl]oxidanesulfonic acid

C16H24O12S (440.0988)

(5-hydroxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate

C20H24O11 (440.1319)

(1s,2r,4s,5r,10s,11s,13r,14s,15r,18r)-14-hydroxy-5-[(2r)-2-hydroxy-1-[(s)-methanesulfinyl]propan-2-yl]-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

(1s,2r,4s,5r,10s,11s,13r,14s,15r,18r)-14-hydroxy-5-[(2r)-2-hydroxy-1-[(s)-methanesulfinyl]propan-2-yl]-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

C20H24O9S (440.1141)

3-hydroxy-5-{[(4r,5r,6e,8e,11s)-3,5,14,16-tetrahydroxy-4-methyl-2-azabicyclo[10.3.1]hexadeca-1(15),2,6,8,12(16),13-hexaen-11-yl]amino}benzoic acid

C23H24N2O7 (440.1583)

(1r,4s,5r,6s)-6-(acetyloxy)-5-[(benzoyloxy)methyl]-5-hydroxy-4-methoxycyclohex-2-en-1-yl benzoate

C24H24O8 (440.1471)

(2e)-3-{4-[(2e)-but-2-en-2-yl]-14-hydroxy-15-(hydroxymethyl)-6-methoxy-7-methyl-10-oxo-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-12-yl}but-2-enoic acid

C24H24O8 (440.1471)

methyl (2r)-4-hydroxy-3-(4-hydroxyphenyl)-2-{[(2s)-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]methyl}-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

(1r,4s,5s,8s,9s,11r,14s,15s,17s,19r)-5,8,15-trihydroxy-11-(methylsulfanyl)-21-thia-3,13-diazahexacyclo[15.3.1.0¹,¹³.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]henicosane-2,12,18-trione

C19H24N2O6S2 (440.1076)

(1s,3r,4r,5r)-3-[(2-carboxyacetyl)oxy]-4-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,5-dihydroxycyclohexane-1-carboxylic acid

C19H20O12 (440.0955)

(8s,9r)-9-hydroxy-8-[(2r)-2-hydroxy-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl]-8h,9h-furo[2,3-h]chromen-2-one

C20H24O11 (440.1319)

[(1s,2r,3r)-7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxysulfonic acid

C20H24O9S (440.1141)

4-[(2-carboxyacetyl)oxy]-3-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,5-dihydroxycyclohexane-1-carboxylic acid

C19H20O12 (440.0955)

14-hydroxy-10-methoxy-4,12-dimethyl-6-[(5-oxooxolan-2-yl)methyl]-5,7,17-trioxapentacyclo[9.6.2.0²,⁶.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-8(18),9,11,13,15(19)-pentaen-16-one

C24H24O8 (440.1471)

(1r,3r,6s,7s,8s,9r,10s,11r,12r,13s,16s,17s)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,⁷.0⁷,¹¹.0¹³,¹⁷]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

(1s,6r,8r,12s,13s,23s)-16,23-dihydroxy-17-methoxy-4-methyl-7,10-dioxa-4,14-diazaheptacyclo[10.8.3.2¹¹,¹⁴.0¹,¹³.0⁶,⁸.0⁶,²³.0¹⁵,²⁰]pentacosa-11(25),15,17,19-tetraene-21,24-dione

C23H24N2O7 (440.1583)

4-(acetyloxy)-5-(3,4-dihydroxyphenyl)-6,11,12-trihydroxy-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),3,5,10,12-hexaen-3-yl acetate

C22H16O10 (440.0743)

14-hydroxy-5-(2-hydroxy-1-methanesulfinylpropan-2-yl)-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

C20H24O9S (440.1141)

(1ar,1br,3r,3ar,5s,7br,9r,9ar)-5-[(1r)-1-bromo-2-hydroxyethyl]-3-hydroxy-1a,5,7b-trimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-9-yl acetate

C22H33BrO4 (440.1562)

(1r,3s,6s,7s,8r,9s,10r,11r,12r,13r,16r,17r)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,⁷.0⁷,¹¹.0¹³,¹⁷]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

6-(3-hydroxy-3-methylbut-1-en-1-yl)-5,7-dimethoxy-2-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one

C24H24O8 (440.1471)

5-(1-bromo-2-hydroxyethyl)-3-hydroxy-1a,5,7b-trimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-9-yl acetate

C22H33BrO4 (440.1562)

5-(2-hydroxy-1-methanesulfonylpropan-2-yl)-10,15-dimethyl-3,6,13,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹²,¹⁴.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

C20H24O9S (440.1141)

(1r,3r,6r,7s,8s,9r,10s,11r,12s,13s,16s,17r)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,⁷.0⁷,¹¹.0¹³,¹⁷]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

(1r,2r,4s,5r,10s,12s,14r,15r,18r)-5-[(2r)-2-hydroxy-1-methanesulfonylpropan-2-yl]-10,15-dimethyl-3,6,13,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹²,¹⁴.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

C20H24O9S (440.1141)

(5-hydroxy-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl (1r)-1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate

C20H24O11 (440.1319)

5-(2-hydroxy-1-methanesulfonylpropan-2-yl)-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

C20H24O9S (440.1141)

(1r,2s,3r,4s)-2,3,4,9-tetrahydroxy-2-methyl-5,10-dioxo-11-(λ⁵-diazynylidene)-1h,3h,4h-benzo[b]fluoren-1-yl 2-methylpropanoate

C22H20N2O8 (440.122)

5-cyano-1,2,3,7-tetrahydroxy-3-methyl-6,11-dioxo-1h,2h,4h-benzo[b]carbazol-4-yl 2-methylpropanoate

C22H20N2O8 (440.122)

methyl (2r)-4-hydroxy-2-{[(3r)-3-hydroxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl]methyl}-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

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

C24H24O8 (440.1471)

(1s,3r,4r,5r)-3-[(2-carboxyacetyl)oxy]-4-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,5-dihydroxycyclohexane-1-carboxylic acid

C19H20O12 (440.0955)

(1r,2s,4r,6r)-14-hydroxy-10-methoxy-4,12-dimethyl-6-{[(2r)-5-oxooxolan-2-yl]methyl}-5,7,17-trioxapentacyclo[9.6.2.0²,⁶.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-8(18),9,11,13,15(19)-pentaen-16-one

C24H24O8 (440.1471)

5,6,15,18-tetrahydroxy-21,22-dithia-3,13-diazahexacyclo[9.9.2.0¹,¹³.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]docos-16-ene-2,8,12-trione

C18H20N2O7S2 (440.0712)

3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 11-ethyl-12-oxo-7,9,13-trioxatetracyclo[6.5.1.0¹,¹⁰.0⁴,¹⁴]tetradeca-2,5-diene-5-carboxylate

C20H24O11 (440.1319)

2-[(2s,3s)-3-chloro-2-hydroxypent-4-en-2-yl]-11-hydroxy-5-(hydroxymethyl)-1-oxatetraphene-4,7,12-trione

C23H17ClO7 (440.0663)

methyl (2r)-4-hydroxy-2-({4-hydroxy-3-[(2s)-2-hydroxy-3-methylbut-3-en-1-yl]phenyl}methyl)-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

2,3,4,9-tetrahydroxy-2-methyl-5,10-dioxo-11-(λ⁵-diazynylidene)-1h,3h,4h-benzo[b]fluoren-1-yl 2-methylpropanoate

C22H20N2O8 (440.122)

(2z,4z)-n-[(2e)-3-[(4s,5r,6s,8r,9z,11e)-5,17-dihydroxy-2-oxo-3,7-dioxatricyclo[11.4.0.0⁶,⁸]heptadeca-1(17),9,11,13,15-pentaen-4-yl]prop-2-en-1-yl]-4-(methoxyimino)but-2-enimidic acid

C23H24N2O7 (440.1583)

(1r,3r,6r,7s,8s,9r,10s,11r,12r,13r,16s,17r)-8-tert-butyl-6,9,12,17-tetrahydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0¹,¹¹.0³,⁷.0⁷,¹¹.0¹³,¹⁷]nonadecane-5,15,18-trione

C20H24O11 (440.1319)

[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[(2-methyl-4-oxopyran-3-yl)oxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate

C19H20O12 (440.0955)

[4,5-dihydroxy-2-(hydroxymethyl)-6-[(3,4,5-trimethoxyphenyl)methoxy]oxan-3-yl]oxidanesulfonic acid

C16H24O12S (440.0988)

{3,4,5-trihydroxy-6-[(2-methyl-4-oxopyran-3-yl)oxy]oxan-2-yl}methyl 3,4,5-trihydroxybenzoate

C19H20O12 (440.0955)

5,8,15-trihydroxy-11-(methylsulfanyl)-21-thia-3,13-diazahexacyclo[15.3.1.0¹,¹³.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]henicosane-2,12,18-trione

C19H24N2O6S2 (440.1076)

methyl (2r)-4-hydroxy-2-{[(3s)-3-hydroxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl]methyl}-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (1s,4s,8r,10s,11s,14s)-11-ethyl-12-oxo-7,9,13-trioxatetracyclo[6.5.1.0¹,¹⁰.0⁴,¹⁴]tetradeca-2,5-diene-5-carboxylate

C20H24O11 (440.1319)

6-[(1e)-3-hydroxy-3-methylbut-1-en-1-yl]-5,7-dimethoxy-2-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one

C24H24O8 (440.1471)

4-[4-(acetyloxy)-3-methoxyphenyl]-7-methoxy-1-oxo-3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan-6-yl acetate

C24H24O8 (440.1471)

(1r,4s,5r,6s,9r,11r,14s,15s,18s,19s)-5,6,15,18-tetrahydroxy-21,22-dithia-3,13-diazahexacyclo[9.9.2.0¹,¹³.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]docos-16-ene-2,8,12-trione

C18H20N2O7S2 (440.0712)

(6r)-9,11-dihydroxy-2,3,6-trimethoxy-8-(3-methylbut-2-en-1-yl)-6h-5,7-dioxatetraphen-12-one

C24H24O8 (440.1471)

16-hydroxy-2-methoxy-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8,10,15-pentaen-12-one

C23H20O9 (440.1107)

3-[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]propoxysulfonic acid

C20H24O9S (440.1141)

(1s,2r,14r,15r)-5,24-dimethoxy-7,9,12,17,20,22-hexaoxaheptacyclo[13.11.0.0²,¹⁴.0³,¹¹.0⁶,¹⁰.0¹⁸,²⁶.0¹⁹,²³]hexacosa-3,5,10,18(26),19(23),24-hexaene-13,16-dione

C22H16O10 (440.0743)

(3-hydroxy-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl (1r)-1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate

C20H24O11 (440.1319)

11-acetyl-5-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7,9,13-trioxatetracyclo[6.5.1.0¹,¹⁰.0⁴,¹⁴]tetradeca-2,5-dien-12-one

C20H24O11 (440.1319)

(1s,2r,4r,6s)-14-hydroxy-10-methoxy-4,12-dimethyl-6-{[(2s)-5-oxooxolan-2-yl]methyl}-5,7,17-trioxapentacyclo[9.6.2.0²,⁶.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-8(18),9,11,13,15(19)-pentaen-16-one

C24H24O8 (440.1471)

2-(3-chloro-2-hydroxypent-4-en-2-yl)-11-hydroxy-5-(hydroxymethyl)-1-oxatetraphene-4,7,12-trione

C23H17ClO7 (440.0663)

methyl (1s,4as,5s,6r,7r,7as)-6-chloro-5,7-dihydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-4-carboxylate

C17H25ClO11 (440.1085)

3-[3-(acetyloxy)prop-1-en-1-yl]-7-methyl-6,8-dioxoisochromen-7-yl 2,4-dihydroxy-6-methylbenzoate

C23H20O9 (440.1107)

2-(3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)furo[2,3-h]chromen-4-one

C23H20O9 (440.1107)

(5r,8s)-1,5-dihydroxy-3-methoxy-8-{[(2r,3s,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6,7,8-tetrahydroxanthen-9-one

C20H24O11 (440.1319)

n-(3-{5,17-dihydroxy-2-oxo-3,7-dioxatricyclo[11.4.0.0⁶,⁸]heptadeca-1(17),9,11,13,15-pentaen-4-yl}prop-1-en-1-yl)-4-(methoxyimino)but-2-enimidic acid

C23H24N2O7 (440.1583)

methyl 4-hydroxy-3-(4-hydroxyphenyl)-2-{[2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]methyl}-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

(7s)-3-[(1e)-3-(acetyloxy)prop-1-en-1-yl]-7-methyl-6,8-dioxoisochromen-7-yl 2,4-dihydroxy-6-methylbenzoate

C23H20O9 (440.1107)

1,5-dihydroxy-3-methoxy-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6,7,8-tetrahydroxanthen-9-one

C20H24O11 (440.1319)

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

C24H24O8 (440.1471)

(2e)-3-(3,4-dimethoxyphenyl)prop-2-en-1-yl (2e)-3-[3,4-bis(acetyloxy)phenyl]prop-2-enoate

C24H24O8 (440.1471)

methyl 2-({3-[(3,3-dimethyloxiran-2-yl)methyl]-4-hydroxyphenyl}methyl)-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate

C24H24O8 (440.1471)

(1s,2r,4r,6s)-14-hydroxy-10-methoxy-4,12-dimethyl-6-{[(2r)-5-oxooxolan-2-yl]methyl}-5,7,17-trioxapentacyclo[9.6.2.0²,⁶.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-8(18),9,11,13,15(19)-pentaen-16-one

C24H24O8 (440.1471)

2-(3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)furo[2,3-h]chromen-4-one

C23H20O9 (440.1107)

(3-hydroxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate

C20H24O11 (440.1319)

(3-hydroxy-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate

C20H24O11 (440.1319)

3-(3,4-dimethoxyphenyl)prop-2-en-1-yl 3-[3,4-bis(acetyloxy)phenyl]prop-2-enoate

C24H24O8 (440.1471)

6-(acetyloxy)-5-[(benzoyloxy)methyl]-5-hydroxy-4-methoxycyclohex-2-en-1-yl benzoate

C24H24O8 (440.1471)

(1s,2r,4s,5r,10s,11s,13r,14s,15r,18r)-14-hydroxy-5-[(2r)-2-hydroxy-1-methanesulfinylpropan-2-yl]-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

(1s,2r,4s,5r,10s,11s,13r,14s,15r,18r)-14-hydroxy-5-[(2r)-2-hydroxy-1-methanesulfinylpropan-2-yl]-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.0²,⁴.0⁴,⁹.0¹¹,¹³.0¹⁵,¹⁸]octadec-8-ene-7,16-dione

C20H24O9S (440.1141)