Vitas-M small molecule compound
(12bS)-2-cyclopropyl-7-(2-ethoxy-3-methoxyphenyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL532800
SMILES CCOc1c(OC)cccc1C1CN2C(=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 C27H29N3O4 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4/c1-4-34-24-17(9-7-11-21(24)33-3)19-14-30-22(31)15-29(16-12-13-16)26(32)27(30,2)25-23(19)18-8-5-6-10-20(18)28-25/h5-11,16,19,28H,4,12-15H2,1-3H3/t19?,27-/m0/s1InChIKey
QACNISLZGBQHPE-NZVRHLSZSA-NSynonyms
956936-45-1(12bS)2cyclopropyl7(2ethoxy3methoxyphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2cyclopropyl7(2ethoxy3methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4cyclopropyl9(2ethoxy3methoxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402958
956936451
CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)C1CC1
InChI=1SC27H29N3O4c14342417(971121(24)333)19143022(31)1529(16121316)26(32)27(302)2523(19)188561020(18)2825h511161928H41215H213H3t19?27m0s1
MFCD06494777
ZINC000008789226
ZINC000008789227
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