Vitas-M small molecule compound
(12aS)-2-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-6-phenyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL538070
SMILES COc1cc(/C=N/N2CC(=O)N3[C@H](C2=O)Cc2c(C3c3ccccc3)[nH]c3c2cccc3)ccc1O
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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 C28H24N4O4 MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O4/c1-36-24-13-17(11-12-23(24)33)15-29-31-16-25(34)32-22(28(31)35)14-20-19-9-5-6-10-21(19)30-26(20)27(32)18-7-3-2-4-8-18/h2-13,15,22,27,30,33H,14,16H2,1H3/b29-15+/t22-,27?/m0/s1InChIKey
QMJFEILZNAYXQM-SJYJOCPQSA-NSynonyms
(12aS)2(((E)(4hydroxy3methoxyphenyl)methylidene)amino)6phenyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2((E)(4hydroxy3methoxybenzylidene)amino)6phenyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6((~(E))(4hydroxy3methoxyphenyl)methylideneamino)2phenyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
135623776
COc1cc(C=NN2CC(=O)N3(C@H)(C2=O)Cc2c(C3c3ccccc3)(nH)c3c2cccc3)ccc1O
InChI=1SC28H24N4O4c136241317(111223(24)33)1529311625(34)3222(28(31)35)1420199561021(19)3026(20)27(32)187324818h2131522273033H1416H21H3b2915+t2227?m0s1
MFCD04146523
ZINC000002107143
ZINC000002107148
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