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4-({S-benzyl-N-[(2,5-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetyl]-D-cysteinyl}amino)butanoic acid

Catalog ID
STK575544
SMILES OC(=O)CCCNC(=O)[C@H](NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C)CSCc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C35H34N2O7S MW 626.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H34N2O7S/c1-21-25-16-27-30(43-22(2)33(27)24-12-7-4-8-13-24)18-29(25)44-35(42)26(21)17-31(38)37-28(34(41)36-15-9-14-32(39)40)20-45-19-23-10-5-3-6-11-23/h3-8,10-13,16,18,28H,9,14-15,17,19-20H2,1-2H3,(H,36,41)(H,37,38)(H,39,40)/t28-/m1/s1
InChIKey
LRPWHLJXOHOGOK-MUUNZHRXSA-N
Synonyms
1014084-30-0
(S)4(3(benzylthio)2(2(25dimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)acetamido)propanamido)butanoicacid
1014084300
4(((2S)3benzylsulfanyl2((2(25dimethyl7oxo3phenylfuro(32g)chromen6yl)acetyl)amino)propanoyl)amino)butanoicacid
4((SbenzylN((25dimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)acetyl)Dcysteinyl)amino)butanoicacid
CC1=C(C(=O)OC2=C1C=C3C(=C2)OC(=C3C4=CC=CC=C4)C)CC(=O)NC(CSCC5=CC=CC=C5)C(=O)NCCCC(=O)O
InChI=1SC35H34N2O7Sc12125162730(4322(2)33(27)24127481324)1829(25)4435(42)26(21)1731(38)3728(34(41)361591432(39)40)20451923105361123h381013161828H91415171920H212H3(H3641)(H3738)(H3940)t28m1s1
MFCD08284521
OC(=O)CCCNC(=O)(C@H)(NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C)CSCc1ccccc1
ZINC000097957101
ZINC97957101

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Available files

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