Vitas-M small molecule compound
N-[5-(acetylamino)-2-methoxyphenyl]-6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}hexanamide
Catalog ID
STL541946
SMILES COc1ccc(cc1NC(=O)CCCCCNc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)NC(=O)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 C36H44N4O8 MW 660.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H44N4O8/c1-21(41)38-24-12-16-31(45-3)29(19-24)40-33(44)10-8-7-9-17-37-28-15-13-25-26(20-30(28)43)27(39-22(2)42)14-11-23-18-32(46-4)35(47-5)36(48-6)34(23)25/h12-13,15-16,18-20,27H,7-11,14,17H2,1-6H3,(H,37,43)(H,38,41)(H,39,42)(H,40,44)/t27-/m0/InChIKey
PQQMVFYZEVTJPT-MHZLTWQESA-NSynonyms
1630914-11-2(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(5acetamido2methoxyphenyl)hexanamide
~(N)(5acetamido2methoxyphenyl)6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)hexanamide
1630914112
91637035
COc1ccc(cc1NC(=O)CCCCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)NC(=O)C
InChI=1SC36H44N4O8c121(41)3824121631(453)29(1924)4033(44)1087917372815132526(2030(28)43)27(3922(2)42)1411231832(464)35(475)36(486)34(23)25h12131516182027H7111417H216H3(H3743)(H3841)(H3942)(H4044)t27m0s1
N(5(acetylamino)2methoxyphenyl)6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)hexanamide
ZINC000217684299
ZINC217684299
Check stock
See real-time availability and sample size for STL541946 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.