Vitas-M small molecule compound
6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-(2,4-dimethoxyphenyl)hexanamide
Catalog ID
STL541781
SMILES COc1ccc(c(c1)OC)NC(=O)CCCCCNc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)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 C35H43N3O8 MW 633.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H43N3O8/c1-21(39)37-26-14-11-22-18-31(44-4)34(45-5)35(46-6)33(22)24-13-16-27(29(40)20-25(24)26)36-17-9-7-8-10-32(41)38-28-15-12-23(42-2)19-30(28)43-3/h12-13,15-16,18-20,26H,7-11,14,17H2,1-6H3,(H,36,40)(H,37,39)(H,38,41)/t26-/m0/s1InChIKey
MNDKPGVQIKLEEV-SANMLTNESA-NSynonyms
1574390-04-7(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(24dimethoxyphenyl)hexanamide
1574390047
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(24dimethoxyphenyl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(24dimethoxyphenyl)hexanamide
75491262
COc1ccc(c(c1)OC)NC(=O)CCCCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC35H43N3O8c121(39)37261411221831(444)34(455)35(466)33(22)24131627(29(40)2025(24)26)36179781032(41)3828151223(422)1930(28)433h12131516182026H7111417H216H3(H3640)(H3739)(H3841)t26m0s1
ZINC000108448138
ZINC108448138
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.