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-(3-hydroxypropyl)-L-methioninamide
Catalog ID
STL547386
SMILES CSCC[C@@H](C(=O)NCCCO)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 C29H39N3O7S MW 573.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H39N3O7S/c1-17(34)31-21-9-7-18-15-25(37-2)27(38-3)28(39-4)26(18)19-8-10-22(24(35)16-20(19)21)32-23(11-14-40-5)29(36)30-12-6-13-33/h8,10,15-16,21,23,33H,6-7,9,11-14H2,1-5H3,(H,30,36)(H,31,34)(H,32,35)/t21-,23-/m0/s1InChIKey
FZUNPIYLVWVWMN-GMAHTHKFSA-NSynonyms
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(3hydroxypropyl)4methylsulfanylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3hydroxypropyl)4(methylthio)butanamide
110208210
CSCC(C@@H)(C(=O)NCCCO)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC29H39N3O7Sc117(34)312197181525(372)27(383)28(394)26(18)1981022(24(35)1620(19)21)3223(1114405)29(36)301261333h8101516212333H6791114H215H3(H3036)(H3134)(H3235)t2123m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(3hydroxypropyl)Lmethioninamide
ZINC000253402057
ZINC253402057
Check stock
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Check stock on Vitas-MAvailable files
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