Vitas-M small molecule compound
(12aS)-2-(3-hydroxypropyl)-6-(2-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL547487
SMILES OCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2OC)[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 C24H25N3O4 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4/c1-31-20-10-5-3-8-16(20)23-22-17(15-7-2-4-9-18(15)25-22)13-19-24(30)26(11-6-12-28)14-21(29)27(19)23/h2-5,7-10,19,23,25,28H,6,11-14H2,1H3/t19-,23?/m0/s1InChIKey
ZTMRUEOYZLKURH-HSTJUUNISA-NSynonyms
956995-01-0(12aS)2(3hydroxypropyl)6(2methoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(3hydroxypropyl)6(2methoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6(3hydroxypropyl)2(2methoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401908
956995010
InChI=1SC24H25N3O4c131201053816(20)232217(15724918(15)2522)131924(30)26(1161228)1421(29)27(19)23h2571019232528H61114H21H3t1923?m0s1
MFCD05677239
OCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccccc2OC)(nH)c2c1cccc2
ZINC000002126050
ZINC000002126051
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