Vitas-M small molecule compound
4-({S-benzyl-N-[(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-L-cysteinyl}amino)butanoic acid
Catalog ID
STK584272
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)N[C@H](C(=O)NCCCC(=O)O)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 C30H32N2O7S MW 564.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O7S/c1-17-19(3)38-25-14-26-22(12-21(17)25)18(2)23(30(37)39-26)13-27(33)32-24(29(36)31-11-7-10-28(34)35)16-40-15-20-8-5-4-6-9-20/h4-6,8-9,12,14,24H,7,10-11,13,15-16H2,1-3H3,(H,31,36)(H,32,33)(H,34,35)/t24-/m0/s1InChIKey
YGGUNSFEMLFDRA-DEOSSOPVSA-NSynonyms
1014084-67-3(R)4(3(benzylthio)2(2(235trimethyl7oxo7Hfuro(32g)chromen6yl)acetamido)propanamido)butanoicacid
1014084673
4(((2R)3benzylsulfanyl2((2(235trimethyl7oxofuro(32g)chromen6yl)acetyl)amino)propanoyl)amino)butanoicacid
4((SbenzylN((235trimethyl7oxo7Hfuro(32g)chromen6yl)acetyl)Lcysteinyl)amino)butanoicacid
CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2)CC(=O)NC(CSCC4=CC=CC=C4)C(=O)NCCCC(=O)O)C)C
InChI=1SC30H32N2O7Sc11719(3)3825142622(1221(17)25)18(2)23(30(37)3926)1327(33)3224(29(36)311171028(34)35)164015208546920h4689121424H71011131516H213H3(H3136)(H3233)(H3435)t24m0s1
MFCD08284479
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)N(C@H)(C(=O)NCCCC(=O)O)CSCc1ccccc1
ZINC000097957050
ZINC97957050
Check stock
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Check stock on Vitas-MAvailable files
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