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-(3-methoxyphenyl)-L-isoleucinamide
Catalog ID
STL543137
SMILES COc1cccc(c1)NC(=O)[C@H]([C@@H](CC)C)Nc1ccc2c(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 C34H41N3O7 MW 603.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H41N3O7/c1-8-19(2)31(34(40)36-22-10-9-11-23(17-22)41-4)37-27-15-13-24-25(18-28(27)39)26(35-20(3)38)14-12-21-16-29(42-5)32(43-6)33(44-7)30(21)24/h9-11,13,15-19,26,31H,8,12,14H2,1-7H3,(H,35,38)(H,36,40)(H,37,39)/t19-,26+,31+/m1/s1InChIKey
HRHQOMNUJMFMQW-JSXXVDJESA-NSynonyms
(2~(S)3~(R))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(3methoxyphenyl)3methylpentanamide
(2S3R)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3methoxyphenyl)3methylpentanamide
110206749
COc1cccc(c1)NC(=O)(C@H)((C@@H)(CC)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC34H41N3O7c1819(2)31(34(40)36221091123(1722)414)372715132425(1828(27)39)26(3520(3)38)1412211629(425)32(436)33(447)30(21)24h9111315192631H81214H217H3(H3538)(H3640)(H3739)t1926+31+m1s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(3methoxyphenyl)Lisoleucinamide
ZINC000253404127
ZINC253404127
Check stock
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Check stock on Vitas-MAvailable files
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