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-(1-methyl-1H-pyrazol-3-yl)-L-leucinamide
Catalog ID
STL540852
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)Nc2ccn(n2)C)CC(C)C)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 C31H39N5O6 MW 577.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H39N5O6/c1-17(2)14-24(31(39)34-27-12-13-36(4)35-27)33-23-11-9-20-21(16-25(23)38)22(32-18(3)37)10-8-19-15-26(40-5)29(41-6)30(42-7)28(19)20/h9,11-13,15-17,22,24H,8,10,14H2,1-7H3,(H,32,37)(H,33,38)(H,34,35,39)/t22-,24-/m0/s1InChIKey
FCNBKFJQMMDFHT-UPVQGACJSA-NSynonyms
1574378-08-7(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methyl~(N)(1methylpyrazol3yl)pentanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4methylN(1methyl1Hpyrazol3yl)pentanamide
1574378087
75491338
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)Nc2ccn(n2)C)CC(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC31H39N5O6c117(2)1424(31(39)3427121336(4)3527)33231192021(1625(23)38)22(3218(3)37)108191526(405)29(416)30(427)28(19)20h9111315172224H81014H217H3(H3237)(H3338)(H343539)t2224m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(1methyl1Hpyrazol3yl)Lleucinamide
ZINC000108448373
ZINC108448373
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.