Vitas-M small molecule compound
tert-butyl 4-{N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-L-isoleucyl}piperazine-1-carboxylate
Catalog ID
STL545022
SMILES CC[C@H]([C@@H](C(=O)N1CCN(CC1)C(=O)OC(C)(C)C)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)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 C36H50N4O8 MW 666.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H50N4O8/c1-10-21(2)31(34(43)39-15-17-40(18-16-39)35(44)48-36(4,5)6)38-27-14-12-24-25(20-28(27)42)26(37-22(3)41)13-11-23-19-29(45-7)32(46-8)33(47-9)30(23)24/h12,14,19-21,26,31H,10-11,13,15-18H2,1-9H3,(H,37,41)(H,38,42)/t21-,26+,31+/m1/s1InChIKey
BOYPMCVOEHOKMU-OUZRWCOESA-NSynonyms
1574353-20-0~(tert)butyl4((2~(S)3~(R))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)3methylpentanoyl)piperazine1carboxylate
CC(C@H)((C@@H)(C(=O)N1CCN(CC1)C(=O)OC(C)(C)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
tertbutyl4((2S3R)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)3methylpentanoyl)piperazine1carboxylate
tertbutyl4(N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Lisoleucyl)piperazine1carboxylate
Registry IDs
ZINC000150653826ZINC150653826
Check stock
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Check stock on Vitas-MAvailable files
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