Vitas-M small molecule compound
(12aS)-6,6-dimethyl-2-(3-methylbutyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL526605
SMILES CC(CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2(C)C)[nH]c2c1cccc2)C
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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/c1-13(2)9-10-23-12-18(25)24-17(20(23)26)11-15-14-7-5-6-8-16(14)22-19(15)21(24,3)4/h5-8,13,17,22H,9-12H2,1-4H3/t17-/m0/s1InChIKey
ICBLBZTZDBJJOV-KRWDZBQOSA-NSynonyms
452316-46-0(12aS)66dimethyl2(3methylbutyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))22dimethyl6(3methylbutyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
(S)2isopentyl66dimethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
1745565
452316460
CC(CCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2(C)C)(nH)c2c1cccc2)C
InChI=1SC21H27N3O2c113(2)910231218(25)2417(20(23)26)111514756816(14)2219(15)21(243)4h58131722H912H214H3t17m0s1
MFCD03006470
ZINC000002087570
ZINC2087570
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