Vitas-M small molecule compound

3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl N-[(4-methylphenyl)sulfonyl]-L-phenylalaninate

Catalog ID
STL537227
SMILES O=C([C@@H](NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1)Oc1cc(C)cc2c1c1CCCCc1c(=O)o2

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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 C30H29NO6S MW 531.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29NO6S/c1-19-12-14-22(15-13-19)38(34,35)31-25(18-21-8-4-3-5-9-21)30(33)37-27-17-20(2)16-26-28(27)23-10-6-7-11-24(23)29(32)36-26/h3-5,8-9,12-17,25,31H,6-7,10-11,18H2,1-2H3/t25-/m0/s1
InChIKey
QGYLMWCPPLCOIW-VWLOTQADSA-N
Synonyms
1173688-28-2
(3methyl6oxo78910tetrahydrobenzo(c)chromen1yl)(2~(S))2((4methylphenyl)sulfonylamino)3phenylpropanoate
(S)3methyl6oxo78910tetrahydro6Hbenzo(c)chromen1yl2(4methylphenylsulfonamido)3phenylpropanoate
1173688282
1751254
3methyl6oxo78910tetrahydro6Hbenzo(c)chromen1ylN((4methylphenyl)sulfonyl)Lphenylalaninate
InChI=1SC30H29NO6Sc119121422(151319)38(3435)3125(18218435921)30(33)37271720(2)162628(27)2310671124(23)29(32)3626h358912172531H67101118H212H3t25m0s1
O=C((C@@H)(NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1)Oc1cc(C)cc2c1c1CCCCc1c(=O)o2
ZINC000002094600
ZINC2094600

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Available files

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