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-[2-(dimethylamino)ethyl]-L-methioninamide
Catalog ID
STL545598
SMILES CSCC[C@@H](C(=O)NCCN(C)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 C30H42N4O6S MW 586.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H42N4O6S/c1-18(35)32-22-10-8-19-16-26(38-4)28(39-5)29(40-6)27(19)20-9-11-23(25(36)17-21(20)22)33-24(12-15-41-7)30(37)31-13-14-34(2)3/h9,11,16-17,22,24H,8,10,12-15H2,1-7H3,(H,31,37)(H,32,35)(H,33,36)/t22-,24-/m0/s1InChIKey
MTSJSDCVOAMKIR-UPVQGACJSA-NSynonyms
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(dimethylamino)ethyl)4methylsulfanylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(dimethylamino)ethyl)4(methylthio)butanamide
110207007
CSCC(C@@H)(C(=O)NCCN(C)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC30H42N4O6Sc118(35)3222108191626(384)28(395)29(406)27(19)2091123(25(36)1721(20)22)3324(1215417)30(37)31131434(2)3h91116172224H8101215H217H3(H3137)(H3235)(H3336)t2224m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(dimethylamino)ethyl)Lmethioninamide
ZINC000253410051
ZINC253410051
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.