Vitas-M small molecule compound
S-benzyl-N-[3-(7-methoxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoyl]-D-cysteine
Catalog ID
STL462766
SMILES COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)N[C@@H](C(=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 C25H27NO6S MW 469.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO6S/c1-15-18-9-11-21(31-3)16(2)23(18)32-25(30)19(15)10-12-22(27)26-20(24(28)29)14-33-13-17-7-5-4-6-8-17/h4-9,11,20H,10,12-14H2,1-3H3,(H,26,27)(H,28,29)/t20-/m1/s1InChIKey
DRPDQJXWWGSWPA-HXUWFJFHSA-NSynonyms
(2S)3benzylsulfanyl2(3(7methoxy48dimethyl2oxochromen3yl)propanoylamino)propanoicacid
(R)3(benzylthio)2(3(7methoxy48dimethyl2oxo2Hchromen3yl)propanamido)propanoicacid
CC1=C(C(=O)OC2=C1C=CC(=C2C)OC)CCC(=O)NC(CSCC3=CC=CC=C3)C(=O)O
COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)N(C@@H)(C(=O)O)CSCc1ccccc1
COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)N(C@H)(C(=O)O)CSCc1ccccc1
InChI=1SC25H27NO6Sc1151891121(313)16(2)23(18)3225(30)19(15)101222(27)2620(24(28)29)143313177546817h491120H101214H213H3(H2627)(H2829)t20m1s1
SbenzylN(3(7methoxy48dimethyl2oxo2Hchromen3yl)propanoyl)Dcysteine
ZINC000011867581
ZINC11867581
Check stock
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Check stock on Vitas-MAvailable files
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