Vitas-M small molecule compound
(12aS)-2-(3-methoxypropyl)-6-(3-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537228
SMILES COCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)C)[nH]c2c1cccc2
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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 C25H27N3O3 MW 417.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3/c1-16-7-5-8-17(13-16)24-23-19(18-9-3-4-10-20(18)26-23)14-21-25(30)27(11-6-12-31-2)15-22(29)28(21)24/h3-5,7-10,13,21,24,26H,6,11-12,14-15H2,1-2H3/t21-,24?/m0/s1InChIKey
GFTUUHYLMMCGHR-XEGCMXMBSA-NSynonyms
956812-11-6(12aS)2(3methoxypropyl)6(3methylphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(3methoxypropyl)6(mtolyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6(3methoxypropyl)2(3methylphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399744
956812116
COCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2cccc(c2)C)(nH)c2c1cccc2
InChI=1SC25H27N3O3c11675817(1316)242319(189341020(18)2623)142125(30)27(11612312)1522(29)28(21)24h3571013212426H611121415H212H3t2124?m0s1
MFCD04145415
ZINC000002157866
ZINC000002157869
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