Vitas-M small molecule compound
(12aS)-2-(tetrahydrofuran-2-ylmethyl)-6-(3,4,5-trimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL549093
SMILES COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CC1CCCO1
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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 C28H31N3O6 MW 505.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O6/c1-34-22-11-16(12-23(35-2)27(22)36-3)26-25-19(18-8-4-5-9-20(18)29-25)13-21-28(33)30(15-24(32)31(21)26)14-17-7-6-10-37-17/h4-5,8-9,11-12,17,21,26,29H,6-7,10,13-15H2,1-3H3/t17?,21-,26?/m0/s1InChIKey
GKZSVBLZGICNGG-MHNCQBCISA-NSynonyms
(12aR)2((tetrahydrofuran2yl)methyl)6(345trimethoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(tetrahydrofuran2ylmethyl)6(345trimethoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6(oxolan2ylmethyl)2(345trimethoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
135639803
InChI=1SC28H31N3O6c134221116(1223(352)27(22)363)262519(18845920(18)2925)132128(33)30(1524(32)31(21)26)141776103717h4589111217212629H67101315H213H3t17?2126?m0s1
MFCD03851692
ZINC000016031362
ZINC000043741158
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