Vitas-M small molecule compound
(12bS)-7-(2-ethoxy-3-methoxyphenyl)-12b-methyl-2-(tetrahydrofuran-2-ylmethyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529384
SMILES CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CC1CCCO1
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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 C29H33N3O5 MW 503.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O5/c1-4-36-26-19(11-7-13-23(26)35-3)21-16-32-24(33)17-31(15-18-9-8-14-37-18)28(34)29(32,2)27-25(21)20-10-5-6-12-22(20)30-27/h5-7,10-13,18,21,30H,4,8-9,14-17H2,1-3H3/t18?,21?,29-/m0/s1InChIKey
MURJECYAIWICQH-KGTPQATISA-NSynonyms
956812-95-6(12bS)7(2ethoxy3methoxyphenyl)12bmethyl2((tetrahydrofuran2yl)methyl)2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(12bS)7(2ethoxy3methoxyphenyl)12bmethyl2(tetrahydrofuran2ylmethyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(S))9(2ethoxy3methoxyphenyl)2methyl4(oxolan2ylmethyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402574
956812956
InChI=1SC29H33N3O5c14362619(1171323(26)353)21163224(33)1731(151898143718)28(34)29(322)2725(21)2010561222(20)3027h571013182130H4891417H213H3t18?21?29m0s1
MFCD06493938
ZINC000012877576
ZINC000012877594
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