Vitas-M small molecule compound
(12aS)-2-cyclohexyl-6-(3-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537381
SMILES Cc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCC1
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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 C27H29N3O2 MW 427.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O2/c1-17-8-7-9-18(14-17)26-25-21(20-12-5-6-13-22(20)28-25)15-23-27(32)29(16-24(31)30(23)26)19-10-3-2-4-11-19/h5-9,12-14,19,23,26,28H,2-4,10-11,15-16H2,1H3/t23-,26?/m0/s1InChIKey
XKSMSOOPHAVSEG-ZZHFZYNASA-NSynonyms
956974-86-0(12aS)2cyclohexyl6(3methylphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2cyclohexyl6(mtolyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6cyclohexyl2(3methylphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399675
956974860
Cc1cccc(c1)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)C1CCCCC1
InChI=1SC27H29N3O2c11787918(1417)262521(2012561322(20)2825)152327(32)29(1624(31)30(23)26)19103241119h59121419232628H2410111516H21H3t2326?m0s1
MFCD04145001
ZINC000002103119
ZINC000002103122
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