Vitas-M small molecule compound
(12aS)-2-(2,2-dimethoxyethyl)-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL541335
SMILES COC(CN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2C)[nH]c2c1cccc2)OC
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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 C25H27N3O4 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4/c1-15-8-4-5-9-16(15)24-23-18(17-10-6-7-11-19(17)26-23)12-20-25(30)27(13-21(29)28(20)24)14-22(31-2)32-3/h4-11,20,22,24,26H,12-14H2,1-3H3/t20-,24?/m0/s1InChIKey
VKNOYTRGTAJFOT-QHELBMECSA-NSynonyms
956951-46-5(12aS)2(22dimethoxyethyl)6(2methylphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(22dimethoxyethyl)6(otolyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6(22dimethoxyethyl)2(2methylphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400062
956951465
COC(CN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccccc2C)(nH)c2c1cccc2)OC
InChI=1SC25H27N3O4c115845916(15)242318(1710671119(17)2623)122025(30)27(1321(29)28(20)24)1422(312)323h41120222426H1214H213H3t2024?m0s1
MFCD05670788
ZINC000002108481
ZINC000002108483
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