Vitas-M small molecule compound
(12aS)-6,6-dimethyl-2-pentyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL526740
SMILES CCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2(C)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 C21H27N3O2 MW 353.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O2/c1-4-5-8-11-23-13-18(25)24-17(20(23)26)12-15-14-9-6-7-10-16(14)22-19(15)21(24,2)3/h6-7,9-10,17,22H,4-5,8,11-13H2,1-3H3/t17-/m0/s1InChIKey
FRHPYELSQBILMQ-KRWDZBQOSA-NSynonyms
450369-21-8(12aS)66dimethyl2pentyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))22dimethyl6pentyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
(S)66dimethyl2pentyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
450369218
7079106
CCCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2(C)C)(nH)c2c1cccc2
InChI=1SC21H27N3O2c145811231318(25)2417(20(23)26)1215149671016(14)2219(15)21(242)3h679101722H4581113H213H3t17m0s1
MFCD03005931
ZINC000004029358
ZINC4029358
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