Vitas-M small molecule compound
(12bS)-7-(2-ethoxy-3-methoxyphenyl)-2-[2-(1H-indol-3-yl)ethyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529043
SMILES CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1c[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 C34H34N4O4 MW 562.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34N4O4/c1-4-42-31-23(12-9-15-28(31)41-3)25-19-38-29(39)20-37(17-16-21-18-35-26-13-7-5-10-22(21)26)33(40)34(38,2)32-30(25)24-11-6-8-14-27(24)36-32/h5-15,18,25,35-36H,4,16-17,19-20H2,1-3H3/t25?,34-/m0/s1InChIKey
QXURNLDESVYAMN-NCJJPXCVSA-NSynonyms
956826-65-6(12bS)2(2(1Hindol3yl)ethyl)7(2ethoxy3methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(12bS)7(2ethoxy3methoxyphenyl)2(2(1Hindol3yl)ethyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(S))9(2ethoxy3methoxyphenyl)4(2(1~(H)indol3yl)ethyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16404626
956826656
CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1c(nH)c2c1cccc2
InChI=1SC34H34N4O4c14423123(1291528(31)413)25193829(39)2037(17162118352613751022(21)26)33(40)34(382)3230(25)2411681427(24)3632h51518253536H416171920H213H3t25?34m0s1
MFCD06767656
ZINC000070700809
ZINC000070700810
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.