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-(morpholin-4-yl)ethyl]-L-methioninamide
Catalog ID
STL544196
SMILES CSCC[C@@H](C(=O)NCCN1CCOCC1)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 C32H44N4O7S MW 628.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H44N4O7S/c1-20(37)34-24-8-6-21-18-28(40-2)30(41-3)31(42-4)29(21)22-7-9-25(27(38)19-23(22)24)35-26(10-17-44-5)32(39)33-11-12-36-13-15-43-16-14-36/h7,9,18-19,24,26H,6,8,10-17H2,1-5H3,(H,33,39)(H,34,37)(H,35,38)/t24-,26-/m0/s1InChIKey
VJAPMRSBEJJZAV-AHWVRZQESA-NSynonyms
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylsulfanyl~(N)(2morpholin4ylethyl)butanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4(methylthio)N(2morpholinoethyl)butanamide
110206208
CSCC(C@@H)(C(=O)NCCN1CCOCC1)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC32H44N4O7Sc120(37)342486211828(402)30(413)31(424)29(21)227925(27(38)1923(22)24)3526(1017445)32(39)33111236131543161436h7918192426H681017H215H3(H3339)(H3437)(H3538)t2426m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(morpholin4yl)ethyl)Lmethioninamide
ZINC000253413659
ZINC253413659
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.