Vitas-M small molecule compound
(12bS)-7-(2-methoxyphenyl)-12b-methyl-2-(3-phenylpropyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL532311
SMILES COc1ccccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCCc1ccccc1
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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 C31H31N3O3 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O3/c1-31-29-28(23-15-6-8-16-25(23)32-29)24(22-14-7-9-17-26(22)37-2)19-34(31)27(35)20-33(30(31)36)18-10-13-21-11-4-3-5-12-21/h3-9,11-12,14-17,24,32H,10,13,18-20H2,1-2H3/t24?,31-/m0/s1InChIKey
JFVDICAUEBSXOO-KEASEGHRSA-NSynonyms
956999-93-2(12bS)7(2methoxyphenyl)12bmethyl2(3phenylpropyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(2methoxyphenyl)12bmethyl2(3phenylpropyl)2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(2methoxyphenyl)2methyl4(3phenylpropyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402090
956999932
COc1ccccc1C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCCc1ccccc1
InChI=1SC31H31N3O3c1312928(2315681625(23)3229)24(2214791726(22)372)1934(31)27(35)2033(30(31)36)18101321114351221h39111214172432H10131820H212H3t24?31m0s1
MFCD06492869
ZINC000012873947
ZINC000012873955
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