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-prop-2-en-1-yl-L-methioninamide
Catalog ID
STL541720
SMILES CSCC[C@@H](C(=O)NCC=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 C29H37N3O6S MW 555.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37N3O6S/c1-7-13-30-29(35)23(12-14-39-6)32-22-11-9-19-20(16-24(22)34)21(31-17(2)33)10-8-18-15-25(36-3)27(37-4)28(38-5)26(18)19/h7,9,11,15-16,21,23H,1,8,10,12-14H2,2-6H3,(H,30,35)(H,31,33)(H,32,34)/t21-,23-/m0/s1InChIKey
YRKCOWQJVAZYFT-GMAHTHKFSA-NSynonyms
1574392-02-1(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylsulfanyl~(N)prop2enylbutanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)Nallyl4(methylthio)butanamide
1574392021
75492575
CSCC(C@@H)(C(=O)NCC=C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC29H37N3O6Sc17133029(35)23(1214396)32221191920(1624(22)34)21(3117(2)33)108181525(363)27(374)28(385)26(18)19h791115162123H18101214H226H3(H3035)(H3133)(H3234)t2123m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Nprop2en1ylLmethioninamide
ZINC000108451531
ZINC108451531
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.