Vitas-M small molecule compound

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

Catalog ID
STL462384
SMILES COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OC(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)C)CC(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 C27H27NO7S MW 509.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27NO7S/c1-16(2)13-24(28-36(31,32)20-9-5-17(3)6-10-20)27(30)34-19-8-12-22-21-11-7-18(33-4)14-23(21)26(29)35-25(22)15-19/h5-12,14-16,24,28H,13H2,1-4H3/t24-/m0/s1
InChIKey
LBSZMSXOVWRAKD-DEOSSOPVSA-N
Synonyms

(8METHOXY6OXOBENZO(C)CHROMEN3YL)(2S)4METHYL2((4METHYLPHENYL)SULFONYLAMINO)PENTANOATE
(S)8methoxy6oxo6Hbenzo(c)chromen3yl4methyl2(4methylphenylsulfonamido)pentanoate
8methoxy6oxo6Hbenzo(c)chromen3ylN((4methylphenyl)sulfonyl)Lleucinate
CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OC2=CC3=C(C=C2)C4=C(C=C(C=C4)OC)C(=O)O3
COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OC(=O)(C@@H)(NS(=O)(=O)c1ccc(cc1)C)CC(C)C
COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OC(=O)(C@H)(NS(=O)(=O)c1ccc(cc1)C)CC(C)C
InChI=1SC27H27NO7Sc116(2)1324(2836(3132)209517(3)61020)27(30)3419812222111718(334)1423(21)26(29)3525(22)1519h51214162428H13H214H3t24m0s1
ZINC000002091815
ZINC02091815
ZINC2091815

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Available files

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