Vitas-M small molecule compound

N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(2-hydroxy-4-methylquinolin-7-yl)leucinamide

Catalog ID
STL548473
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NC(C(=O)Nc2ccc3c(c2)nc(cc3C)O)CC(C)C)NC(=O)C)cc(c1OC)OC

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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 C37H42N4O7 MW 654.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H42N4O7/c1-19(2)14-30(37(45)39-23-9-10-24-20(3)15-33(44)41-29(24)17-23)40-28-13-11-25-26(18-31(28)43)27(38-21(4)42)12-8-22-16-32(46-5)35(47-6)36(48-7)34(22)25/h9-11,13,15-19,27,30H,8,12,14H2,1-7H3,(H,38,42)(H,39,45)(H,40,43)(H,41,44)/t27-,30?/
InChIKey
CQQFAQVULCOSGR-CEBUJLNPSA-N
Synonyms

122169708
2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methyl~(N)(4methyl2oxo1~(H)quinolin7yl)pentanamide
InChI=1SC37H42N4O7c119(2)1430(37(45)39239102420(3)1533(44)4129(24)1723)402813112526(1831(28)43)27(3821(4)42)128221632(465)35(476)36(487)34(22)25h9111315192730H81214H217H3(H3842)(H3945)(H4043)(H4144)t2730?m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2hydroxy4methylquinolin7yl)leucinamide
ZINC000263584978
ZINC000409413606

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Available files

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