Vitas-M small molecule compound
N-[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]glycylglycyl-S-benzyl-L-cysteine
Catalog ID
STK594783
SMILES O=C(NCC(=O)N[C@H](C(=O)O)CSCc1ccccc1)CNC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
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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 C31H33N3O8S MW 607.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O8S/c1-17-19(3)41-25-12-26-23(11-22(17)25)18(2)21(31(40)42-26)9-10-27(35)32-13-28(36)33-14-29(37)34-24(30(38)39)16-43-15-20-7-5-4-6-8-20/h4-8,11-12,24H,9-10,13-16H2,1-3H3,(H,32,35)(H,33,36)(H,34,37)(H,38,39)/t24-/m0/s1InChIKey
QESDHNMLLDXOAW-DEOSSOPVSA-NSynonyms
1014003-31-6(2R)3benzylsulfanyl2((2((2(3(235trimethyl7oxofuro(32g)chromen6yl)propanoylamino)acetyl)amino)acetyl)amino)propanoicacid
(R)3(benzylthio)2(2(2(3(235trimethyl7oxo7Hfuro(32g)chromen6yl)propanamido)acetamido)acetamido)propanoicacid
1014003316
CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2)CCC(=O)NCC(=O)NCC(=O)NC(CSCC4=CC=CC=C4)C(=O)O)C)C
InChI=1SC31H33N3O8Sc11719(3)4125122623(1122(17)25)18(2)21(31(40)4226)91027(35)321328(36)331429(37)3424(30(38)39)164315207546820h48111224H9101316H213H3(H3235)(H3336)(H3437)(H3839)t24m0s1
MFCD08284405
N(3(235trimethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)glycylglycylSbenzylLcysteine
O=C(NCC(=O)N(C@H)(C(=O)O)CSCc1ccccc1)CNC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
ZINC000097956946
ZINC97956946
Check stock
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Check stock on Vitas-MAvailable files
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