Vitas-M small molecule compound
(12aS)-2-[2-(4-methoxyphenyl)ethyl]-6-(4-methylphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL536744
SMILES COc1ccc(cc1)CCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)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 C30H29N3O3 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O3/c1-19-7-11-21(12-8-19)29-28-24(23-5-3-4-6-25(23)31-28)17-26-30(35)32(18-27(34)33(26)29)16-15-20-9-13-22(36-2)14-10-20/h3-14,26,29,31H,15-18H2,1-2H3/t26-,29?/m0/s1InChIKey
MWAAKLWQNZISNC-QUWDGAPNSA-NSynonyms
956960-57-9(12aS)2(2(4methoxyphenyl)ethyl)6(4methylphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(4methoxyphenethyl)6(ptolyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6(2(4methoxyphenyl)ethyl)2(4methylphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399768
956960579
COc1ccc(cc1)CCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)C)(nH)c2c1cccc2
InChI=1SC30H29N3O3c11971121(12819)292824(23534625(23)3128)172630(35)32(1827(34)33(26)29)16152091322(362)141020h314262931H1518H212H3t2629?m0s1
MFCD04145523
ZINC000002103568
ZINC000002103570
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