Vitas-M small molecule compound

8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl N-[(4-methylphenyl)sulfonyl]-L-phenylalaninate

Catalog ID
STL462414
SMILES COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OC(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1

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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 C30H25NO7S MW 543.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25NO7S/c1-19-8-12-23(13-9-19)39(34,35)31-27(16-20-6-4-3-5-7-20)30(33)37-22-11-15-25-24-14-10-21(36-2)17-26(24)29(32)38-28(25)18-22/h3-15,17-18,27,31H,16H2,1-2H3/t27-/m0/s1
InChIKey
OXUCTGCTQCWWLJ-MHZLTWQESA-N
Synonyms

(8METHOXY6OXOBENZO(C)CHROMEN3YL)(2S)2((4METHYLPHENYL)SULFONYLAMINO)3PHENYLPROPANOATE
(S)8methoxy6oxo6Hbenzo(c)chromen3yl2(4methylphenylsulfonamido)3phenylpropanoate
8methoxy6oxo6Hbenzo(c)chromen3ylN((4methylphenyl)sulfonyl)Lphenylalaninate
CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)C5=C(C=C(C=C5)OC)C(=O)O4
COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OC(=O)(C@@H)(NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1
COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OC(=O)(C@H)(NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1
InChI=1SC30H25NO7Sc11981223(13919)39(3435)3127(16206435720)30(33)372211152524141021(362)1726(24)29(32)3828(25)1822h31517182731H16H212H3t27m0s1
ZINC000002093052
ZINC2093052

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Available files

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