Vitas-M small molecule compound

methyl N-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-L-methioninate

Catalog ID
STL545742
SMILES CSCC[C@@H](C(=O)OC)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)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 C26H31NO6S MW 485.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO6S/c1-14-16(9-10-22(28)27-20(11-12-34-4)26(30)31-3)25(29)33-23-15(2)24-19(13-18(14)23)17-7-5-6-8-21(17)32-24/h13,20H,5-12H2,1-4H3,(H,27,28)/t20-/m0/s1
InChIKey
OLSQTEKYDDKIEY-FQEVSTJZSA-N
Synonyms
1630917-23-5
(S)methyl2(3(411dimethyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)propanamido)4(methylthio)butanoate
1630917235
91638561
CSCC(C@@H)(C(=O)OC)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2
InChI=1SC26H31NO6Sc11416(91022(28)2720(1112344)26(30)313)25(29)332315(2)2419(1318(14)23)17756821(17)3224h1320H512H214H3(H2728)t20m0s1
methyl(2~(S))2(3(411dimethyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)propanoylamino)4methylsulfanylbutanoate
methylN(3(411dimethyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)propanoyl)Lmethioninate
ZINC000217913345
ZINC217913345

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Available files

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