Vitas-M small molecule compound
N-[(7S)-10-{[4-(6-bromo-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-4-oxobutyl]amino}-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Catalog ID
STL547752
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)N2CCc3c(C2)c2cccc(c2[nH]3)Br)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 C36H39BrN4O6 MW 703.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H39BrN4O6/c1-20(42)39-27-12-10-21-17-31(45-2)35(46-3)36(47-4)33(21)22-11-13-29(30(43)18-24(22)27)38-15-6-9-32(44)41-16-14-28-25(19-41)23-7-5-8-26(37)34(23)40-28/h5,7-8,11,13,17-18,27,40H,6,9-10,12,14-16,19H2,1-4H3,(H,38,43)(H,39,42)/t27-/m0/s1InChIKey
MMDFZEQZOYFKMR-MHZLTWQESA-NSynonyms
(S)N(10((4(6bromo34dihydro1Hpyrido(43b)indol2(5H)yl)4oxobutyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
~(N)((7~(S))10((4(6bromo1345tetrahydropyrido(43b)indol2yl)4oxobutyl)amino)123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
121542178
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)N2CCc3c(C2)c2cccc(c2(nH)3)Br)NC(=O)C)cc(c1OC)OC
InChI=1SC36H39BrN4O6c120(42)39271210211731(452)35(463)36(474)33(21)22111329(30(43)1824(22)27)38156932(44)4116142825(1941)2375826(37)34(23)4028h578111317182740H691012141619H214H3(H3843)(H3942)t27m0s1
N((7S)10((4(6bromo1345tetrahydro2Hpyrido(43b)indol2yl)4oxobutyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000263585788
ZINC263585788
Check stock
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