Vitas-M small molecule compound
(12aS)-6-(2-ethoxyphenyl)-2-[2-(4-methoxyphenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL536739
SMILES CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccc(cc1)OC
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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 C31H31N3O4 MW 509.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O4/c1-3-38-27-11-7-5-9-23(27)30-29-24(22-8-4-6-10-25(22)32-29)18-26-31(36)33(19-28(35)34(26)30)17-16-20-12-14-21(37-2)15-13-20/h4-15,26,30,32H,3,16-19H2,1-2H3/t26-,30?/m0/s1InChIKey
GFVFCIZHEZTQNV-PKMDPOOCSA-NSynonyms
956974-02-0(12aS)6(2ethoxyphenyl)2(2(4methoxyphenyl)ethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(2ethoxyphenyl)2(4methoxyphenethyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(2ethoxyphenyl)6(2(4methoxyphenyl)ethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400431
956974020
CCOc1ccccc1C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CCc1ccc(cc1)OC
InChI=1SC31H31N3O4c1338271175923(27)302924(228461025(22)3229)182631(36)33(1928(35)34(26)30)171620121421(372)151320h415263032H31619H212H3t2630?m0s1
MFCD05671400
ZINC000012864644
ZINC000012864651
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