Vitas-M small molecule compound
(12aR)-2-cyclohexyl-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
STL528125
SMILES COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)[C@H]2Cc2c1[nH]c1c2cccc1)C1CCCCC1
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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 C29H33N3O5 MW 503.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O5/c1-35-23-13-17(14-24(36-2)28(23)37-3)27-26-20(19-11-7-8-12-21(19)30-26)15-22-29(34)31(16-25(33)32(22)27)18-9-5-4-6-10-18/h7-8,11-14,18,22,27,30H,4-6,9-10,15-16H2,1-3H3/t22-,27?/m1/s1InChIKey
BIYYDBSSGYKVQK-XVPAFAEQSA-NSynonyms
956927-94-9(12aR)2cyclohexyl6(345trimethoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aR)2cyclohexyl6(345trimethoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(R))6cyclohexyl2(345trimethoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16398949
956927949
COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)(C@H)2Cc2c1(nH)c1c2cccc1)C1CCCCC1
InChI=1SC29H33N3O5c135231317(1424(362)28(23)373)272620(1911781221(19)3026)152229(34)31(1625(33)32(22)27)1895461018h78111418222730H469101516H213H3t2227?m1s1
MFCD03853038
ZINC000002094224
ZINC000002094226
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