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-(1H-benzimidazol-6-yl)hexanamide
Catalog ID
STL546485
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCCCC(=O)Nc2ccc3c(c2)[nH]cn3)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 C34H39N5O6 MW 613.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H39N5O6/c1-20(40)38-25-12-9-21-16-30(43-2)33(44-3)34(45-4)32(21)23-11-14-27(29(41)18-24(23)25)35-15-7-5-6-8-31(42)39-22-10-13-26-28(17-22)37-19-36-26/h10-11,13-14,16-19,25H,5-9,12,15H2,1-4H3,(H,35,41)(H,36,37)(H,38,40)(H,39,42)/t25-/m0/s1InChIKey
MFDWYFAPRRCFQN-VWLOTQADSA-NSynonyms
(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1Hbenzo(d)imidazol5yl)hexanamide
121541265
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(3~(H)benzimidazol5yl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1Hbenzimidazol6yl)hexanamide
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCCCC(=O)Nc2ccc3c(c2)nc(nH)3)NC(=O)C)cc(c1OC)OC
InChI=1SC34H39N5O6c120(40)3825129211630(432)33(443)34(454)32(21)23111427(29(41)1824(23)25)3515756831(42)392210132628(1722)37193626h10111314161925H591215H214H3(H3541)(H3637)(H3840)(H3942)t25m0s1
ZINC000263585765
ZINC263585765
Check stock
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Check stock on Vitas-MAvailable files
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