Vitas-M small molecule compound
(12aS)-2-(2-methoxybenzyl)-6-(3,4,5-trimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL457931
SMILES COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1OC
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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 C31H31N3O6 MW 541.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O6/c1-37-24-12-8-5-9-18(24)16-33-17-27(35)34-23(31(33)36)15-21-20-10-6-7-11-22(20)32-28(21)29(34)19-13-25(38-2)30(40-4)26(14-19)39-3/h5-14,23,29,32H,15-17H2,1-4H3/t23-,29?/m0/s1InChIKey
GXGWFEKJRLBOAL-QASNXKAYSA-NSynonyms
(12aR)2(2methoxybenzyl)6(345trimethoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(2methoxybenzyl)6(345trimethoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2oanisyl6(345trimethoxyphenyl)671212atetrahydro3Hpyrazino(12b)$bcarboline14quinone
COC1=CC=CC=C1CN2CC(=O)N3C(C2=O)CC4=C(C3C5=CC(=C(C(=C5)OC)OC)OC)NC6=CC=CC=C46
COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)Cc1ccccc1OC
COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)(C@H)2Cc2c1(nH)c1c2cccc1)Cc1ccccc1OC
InChI=1SC31H31N3O6c137241285918(24)16331727(35)3423(31(33)36)15212010671122(20)3228(21)29(34)191325(382)30(404)26(1419)393h514232932H1517H214H3t2329?m0s1
MFCD03854356
ZINC000102575885
ZINC000102575887
Check stock
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Check stock on Vitas-MAvailable files
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