Vitas-M small molecule compound
3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]norvalinate
Catalog ID
STL462427
SMILES CCCC(C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)NS(=O)(=O)c1ccc(cc1)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 C30H31NO6S MW 533.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31NO6S/c1-5-9-26(31-38(34,35)23-14-12-19(2)13-15-23)30(33)36-27-17-16-24-20(3)25(18-22-10-7-6-8-11-22)29(32)37-28(24)21(27)4/h6-8,10-17,26,31H,5,9,18H2,1-4H3InChIKey
KHLDCERRWOWIII-UHFFFAOYSA-NSynonyms
(3BENZYL48DIMETHYL2OXOCHROMEN7YL)2((4METHYLPHENYL)SULFONYLAMINO)PENTANOATE
3benzyl48dimethyl2oxo2Hchromen7yl2(4methylphenylsulfonamido)pentanoate
3benzyl48dimethyl2oxo2Hchromen7ylN((4methylphenyl)sulfonyl)norvalinate
CCC(C@H)(C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)NS(=O)(=O)c1ccc(cc1)C
CCCC(C(=O)OC1=C(C2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)C)NS(=O)(=O)C4=CC=C(C=C4)C
InChI=1SC30H31NO6Sc15926(3138(3435)23141219(2)131523)30(33)362717162420(3)25(1822107681122)29(32)3728(24)21(27)4h6810172631H5918H214H3
MFCD06764109
ZINC000002092523
ZINC000002092525
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