Vitas-M small molecule compound
(12aS)-2-[2-(3,4-dimethoxyphenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL457933
SMILES COc1cc(CCN2CC(=O)N3[C@H](C2=O)Cc2c(C3)[nH]c3c2cccc3)ccc1OC
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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 C24H25N3O4 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4/c1-30-21-8-7-15(11-22(21)31-2)9-10-26-14-23(28)27-13-19-17(12-20(27)24(26)29)16-5-3-4-6-18(16)25-19/h3-8,11,20,25H,9-10,12-14H2,1-2H3/t20-/m0/s1InChIKey
XNBDUVGFUYFKRV-FQEVSTJZSA-NSynonyms
956364-41-3(12aS)2(2(34dimethoxyphenyl)ethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2homoveratryl671212atetrahydro3Hpyrazino(12b)$bcarboline14quinone
(S)2(34dimethoxyphenethyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
956364413
COC1=C(C=C(C=C1)CCN2CC(=O)N3CC4=C(CC3C2=O)C5=CC=CC=C5N4)OC
COc1cc(CCN2CC(=O)N3(C@H)(C2=O)Cc2c(C3)(nH)c3c2cccc3)ccc1OC
InChI=1SC24H25N3O4c130218715(1122(21)312)910261423(28)27131917(1220(27)24(26)29)16534618(16)2519h38112025H9101214H212H3t20m0s1
MFCD03659885
ZINC000004040633
ZINC04040633
ZINC4040633
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