Vitas-M small molecule compound
(7S)-N-{(2S)-3-methyl-1-[(3-methylbutyl)amino]-1-oxobutan-2-yl}-5-oxo-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamide
Catalog ID
STL531120
SMILES CC(CCNC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)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 C29H34N4O3 MW 486.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N4O3/c1-16(2)13-14-30-28(35)24(17(3)4)32-27(34)23-15-21-18-9-7-8-12-22(18)31-25(21)26-19-10-5-6-11-20(19)29(36)33(23)26/h5-12,16-17,23-24,26,31H,13-15H2,1-4H3,(H,30,35)(H,32,34)/t23-,24-,26?/m0/s1InChIKey
QOQLJFAWHPEFKJ-OKHNBNEASA-NSynonyms
956156-61-9(11~(S))~(N)((2~(S))3methyl1(3methylbutylamino)1oxobutan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)3methyl1((3methylbutyl)amino)1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1(isopentylamino)3methyl1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16405380
956156619
CC(CCNC(=O)(C@H)(C(C)C)NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1)C
InChI=1SC29H34N4O3c116(2)13143028(35)24(17(3)4)3227(34)231521189781222(18)3125(21)261910561120(19)29(36)33(23)26h512161723242631H1315H214H3(H3035)(H3234)t232426?m0s1
MFCD06770325
ZINC000008791657
ZINC000008791658
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.