Vitas-M small molecule compound
(12aS)-2-(1,3-benzodioxol-5-ylmethyl)-6-(2-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537700
SMILES O=C1N(Cc2ccc3c(c2)OCO3)CC(=O)N2[C@H]1Cc1c(C2c2ccccc2C)[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 C29H25N3O4 MW 479.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O4/c1-17-6-2-3-7-19(17)28-27-21(20-8-4-5-9-22(20)30-27)13-23-29(34)31(15-26(33)32(23)28)14-18-10-11-24-25(12-18)36-16-35-24/h2-12,23,28,30H,13-16H2,1H3/t23-,28?/m0/s1InChIKey
WZIMIWMLZPMWGY-UHFKCPIBSA-NSynonyms
956920-25-5(12aS)2(13benzodioxol5ylmethyl)6(2methylphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(benzo(d)(13)dioxol5ylmethyl)6(otolyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6(13benzodioxol5ylmethyl)2(2methylphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400355
956920255
InChI=1SC29H25N3O4c117623719(17)282721(20845922(20)3027)132329(34)31(1526(33)32(23)28)141810112425(1218)36163524h212232830H1316H21H3t2328?m0s1
MFCD05671285
O=C1N(Cc2ccc3c(c2)OCO3)CC(=O)N2(C@H)1Cc1c(C2c2ccccc2C)(nH)c2c1cccc2
ZINC000002109743
ZINC000002109745
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