Vitas-M small molecule compound
(12bS)-2-cyclopropyl-7-(3-ethoxy-4-propoxyphenyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL531428
SMILES CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)C1CC1
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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 C29H33N3O4 MW 487.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O4/c1-4-14-36-23-13-10-18(15-24(23)35-5-2)21-16-32-25(33)17-31(19-11-12-19)28(34)29(32,3)27-26(21)20-8-6-7-9-22(20)30-27/h6-10,13,15,19,21,30H,4-5,11-12,14,16-17H2,1-3H3/t21?,29-/m0/s1InChIKey
OVDKFFISXSODCJ-TXMUIZFDSA-NSynonyms
956929-43-4(12bS)2cyclopropyl7(3ethoxy4propoxyphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2cyclopropyl7(3ethoxy4propoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4cyclopropyl9(3ethoxy4propoxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16403523
956929434
CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)C1CC1
InChI=1SC29H33N3O4c14143623131018(1524(23)3552)21163225(33)1731(19111219)28(34)29(323)2726(21)20867922(20)3027h6101315192130H451112141617H213H3t21?29m0s1
MFCD06495975
ZINC000012880553
ZINC000012880560
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