Vitas-M small molecule compound
(12aS)-2-(3,4-dimethoxybenzyl)-6-(2-ethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL536709
SMILES CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccc(c(c1)OC)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 C31H31N3O5 MW 525.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O5/c1-4-39-25-12-8-6-10-21(25)30-29-22(20-9-5-7-11-23(20)32-29)16-24-31(36)33(18-28(35)34(24)30)17-19-13-14-26(37-2)27(15-19)38-3/h5-15,24,30,32H,4,16-18H2,1-3H3/t24-,30?/m0/s1InChIKey
GIGLWDCNAYTEBF-YJJLJQPASA-NSynonyms
956915-27-8(12aS)2(34dimethoxybenzyl)6(2ethoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(34dimethoxybenzyl)6(2ethoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6((34dimethoxyphenyl)methyl)2(2ethoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400220
956915278
CCOc1ccccc1C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)Cc1ccc(c(c1)OC)OC
InChI=1SC31H31N3O5c14392512861021(25)302922(209571123(20)3229)162431(36)33(1828(35)34(24)30)1719131426(372)27(1519)383h515243032H41618H213H3t2430?m0s1
MFCD05671051
ZINC000002109005
ZINC000002109007
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