Vitas-M small molecule compound
4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-benzylbutanamide
Catalog ID
STL578802
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)NCc2ccccc2)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 C32H37N3O6 MW 559.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H37N3O6/c1-20(36)35-25-14-12-22-17-28(39-2)31(40-3)32(41-4)30(22)23-13-15-26(27(37)18-24(23)25)33-16-8-11-29(38)34-19-21-9-6-5-7-10-21/h5-7,9-10,13,15,17-18,25H,8,11-12,14,16,19H2,1-4H3,(H,33,37)(H,34,38)(H,35,36)/t25-/m0/s1InChIKey
ANVYIBBCWGNCAL-VWLOTQADSA-NSynonyms
(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)Nbenzylbutanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)Nbenzylbutanamide
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)NCc2ccccc2)NC(=O)C)cc(c1OC)OC
InChI=1SC32H37N3O6c120(36)35251412221728(392)31(403)32(414)30(22)23131526(27(37)1824(23)25)331681129(38)34192196571021h579101315171825H81112141619H214H3(H3337)(H3438)(H3536)t25m0s1
MFCD33397250
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