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-pyridin-4-yl-L-leucinamide

Catalog ID
STL541614
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)Nc2ccncc2)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 C32H38N4O6 MW 574.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H38N4O6/c1-18(2)15-26(32(39)35-21-11-13-33-14-12-21)36-25-10-8-22-23(17-27(25)38)24(34-19(3)37)9-7-20-16-28(40-4)30(41-5)31(42-6)29(20)22/h8,10-14,16-18,24,26H,7,9,15H2,1-6H3,(H,34,37)(H,36,38)(H,33,35,39)/t24-,26-/m0/s1
InChIKey
SYPDGNYZGXDURU-AHWVRZQESA-N
Synonyms
1574377-62-0
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methyl~(N)pyridin4ylpentanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4methylN(pyridin4yl)pentanamide
1574377620
75491243
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)Nc2ccncc2)CC(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC32H38N4O6c118(2)1526(32(39)3521111333141221)36251082223(1727(25)38)24(3419(3)37)97201628(404)30(415)31(426)29(20)22h8101416182426H7915H216H3(H3437)(H3638)(H333539)t2426m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Npyridin4ylLleucinamide
ZINC000108448085
ZINC108448085

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Available files

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