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-benzyl-L-methioninamide
Catalog ID
STL540076
SMILES CSCC[C@@H](C(=O)NCc1ccccc1)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 C33H39N3O6S MW 605.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N3O6S/c1-20(37)35-25-13-11-22-17-29(40-2)31(41-3)32(42-4)30(22)23-12-14-26(28(38)18-24(23)25)36-27(15-16-43-5)33(39)34-19-21-9-7-6-8-10-21/h6-10,12,14,17-18,25,27H,11,13,15-16,19H2,1-5H3,(H,34,39)(H,35,37)(H,36,38)/t25-,27-/m0/s1InChIKey
AJUGMSGMVKUZSE-BDYUSTAISA-NSynonyms
1574380-64-5(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)benzyl4methylsulfanylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)Nbenzyl4(methylthio)butanamide
1574380645
75492014
CSCC(C@@H)(C(=O)NCc1ccccc1)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC33H39N3O6Sc120(37)35251311221729(402)31(413)32(424)30(22)23121426(28(38)1824(23)25)3627(1516435)33(39)34192197681021h610121417182527H1113151619H215H3(H3439)(H3537)(H3638)t2527m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)NbenzylLmethioninamide
ZINC000108450103
ZINC108450103
Check stock
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Check stock on Vitas-MAvailable files
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