Vitas-M small molecule compound
3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-valinate
Catalog ID
STL461787
SMILES CC([C@@H](C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1)NS(=O)(=O)c1ccc(cc1)C)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 C29H29NO6S MW 519.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29NO6S/c1-18(2)27(30-37(33,34)23-13-10-19(3)11-14-23)29(32)35-22-12-15-24-20(4)25(28(31)36-26(24)17-22)16-21-8-6-5-7-9-21/h5-15,17-18,27,30H,16H2,1-4H3/t27-/m0/s1InChIKey
NVEMKHFLNPWIMP-MHZLTWQESA-NSynonyms
956047-18-0(3BENZYL4METHYL2OXOCHROMEN7YL)(2S)3METHYL2((4METHYLPHENYL)SULFONYLAMINO)BUTANOATE
(S)3benzyl4methyl2oxo2Hchromen7yl3methyl2(4methylphenylsulfonamido)butanoate
3benzyl4methyl2oxo2Hchromen7ylN((4methylphenyl)sulfonyl)Lvalinate
956047180
CC((C@@H)(C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1)NS(=O)(=O)c1ccc(cc1)C)C
CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC2=CC3=C(C=C2)C(=C(C(=O)O3)CC4=CC=CC=C4)C
InChI=1SC29H29NO6Sc118(2)27(3037(3334)23131019(3)111423)29(32)352212152420(4)25(28(31)3626(24)1722)16218657921h51517182730H16H214H3t27m0s1
ZINC000002111977
ZINC02111977
ZINC2111977
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