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-(4-methoxybenzyl)-L-alaninamide
Catalog ID
STL540474
SMILES COc1ccc(cc1)CNC(=O)[C@@H](Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)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 C32H37N3O7 MW 575.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H37N3O7/c1-18(32(38)33-17-20-7-10-22(39-3)11-8-20)34-26-14-12-23-24(16-27(26)37)25(35-19(2)36)13-9-21-15-28(40-4)30(41-5)31(42-6)29(21)23/h7-8,10-12,14-16,18,25H,9,13,17H2,1-6H3,(H,33,38)(H,34,37)(H,35,36)/t18-,25-/m0/s1InChIKey
VDPVILOJUMHYEC-BVZFJXPGSA-NSynonyms
1574391-27-7(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((4methoxyphenyl)methyl)propanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(4methoxybenzyl)propanamide
1574391277
75491562
COc1ccc(cc1)CNC(=O)(C@@H)(Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC32H37N3O7c118(32(38)33172071022(393)11820)342614122324(1627(26)37)25(3519(2)36)139211528(404)30(415)31(426)29(21)23h78101214161825H91317H216H3(H3338)(H3437)(H3536)t1825m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(4methoxybenzyl)Lalaninamide
ZINC000108448951
ZINC108448951
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.