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-1H-indol-4-yl-L-valinamide
Catalog ID
STL540147
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)Nc2cccc3c2cc[nH]3)C(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 C34H38N4O6 MW 598.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H38N4O6/c1-18(2)31(34(41)38-25-9-7-8-24-22(25)14-15-35-24)37-27-13-11-21-23(17-28(27)40)26(36-19(3)39)12-10-20-16-29(42-4)32(43-5)33(44-6)30(20)21/h7-9,11,13-18,26,31,35H,10,12H2,1-6H3,(H,36,39)(H,37,40)(H,38,41)/t26-,31-/m0/s1InChIKey
PKIQVSKSIGELQJ-HVNZXBJASA-NSynonyms
1574380-86-1(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(1~(H)indol4yl)3methylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1Hindol4yl)3methylbutanamide
1574380861
75491283
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)Nc2cccc3c2cc(nH)3)C(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC34H38N4O6c118(2)31(34(41)38259782422(25)14153524)372713112123(1728(27)40)26(3619(3)39)1210201629(424)32(435)33(446)30(20)21h79111318263135H1012H216H3(H3639)(H3740)(H3841)t2631m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N1Hindol4ylLvalinamide
ZINC000108448206
ZINC108448206
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.