Vitas-M small molecule compound
(12aS)-6-(3-methoxyphenyl)-2-(3-methoxypropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL538138
SMILES COCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)OC)[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 C25H27N3O4 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4/c1-31-12-6-11-27-15-22(29)28-21(25(27)30)14-19-18-9-3-4-10-20(18)26-23(19)24(28)16-7-5-8-17(13-16)32-2/h3-5,7-10,13,21,24,26H,6,11-12,14-15H2,1-2H3/t21-,24?/m0/s1InChIKey
PJBBSBPTBKLNPE-XEGCMXMBSA-NSynonyms
956942-79-3(12aS)6(3methoxyphenyl)2(3methoxypropyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(3methoxyphenyl)2(3methoxypropyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(3methoxyphenyl)6(3methoxypropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399851
956942793
COCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2cccc(c2)OC)(nH)c2c1cccc2
InChI=1SC25H27N3O4c13112611271522(29)2821(25(27)30)1419189341020(18)2623(19)24(28)1675817(1316)322h3571013212426H611121415H212H3t2124?m0s1
MFCD04146068
ZINC000002104967
ZINC000002104968
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