Vitas-M small molecule compound

S-methyl-N-[(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]-L-cysteine

Catalog ID
STL534919
SMILES CSC[C@@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2

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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 C22H23NO6S MW 429.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO6S/c1-11-13-7-15-12-5-3-4-6-17(12)28-19(15)9-18(13)29-22(27)14(11)8-20(24)23-16(10-30-2)21(25)26/h7,9,16H,3-6,8,10H2,1-2H3,(H,23,24)(H,25,26)/t16-/m0/s1
InChIKey
VJWPMKCKJKJOFG-INIZCTEOSA-N
Synonyms
956683-98-0
(2~(R))2((2(4methyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)acetyl)amino)3methylsulfanylpropanoicacid
(R)2(2(4methyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)acetamido)3(methylthio)propanoicacid
1772430
956683980
CSC(C@@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
InChI=1SC22H23NO6Sc1111371512534617(12)2819(15)918(13)2922(27)14(11)820(24)2316(10302)21(25)26h7916H36810H212H3(H2324)(H2526)t16m0s1
MFCD05674036
SmethylN((4methyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)acetyl)Lcysteine
ZINC000002117832
ZINC2117832

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.