Vitas-M small molecule compound
(12aS)-6-(2,4-dimethoxyphenyl)-2-(furan-2-ylmethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537961
SMILES COc1cc(OC)ccc1C1N2C(=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 C27H25N3O5 MW 471.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O5/c1-33-16-9-10-19(23(12-16)34-2)26-25-20(18-7-3-4-8-21(18)28-25)13-22-27(32)29(15-24(31)30(22)26)14-17-6-5-11-35-17/h3-12,22,26,28H,13-15H2,1-2H3/t22-,26?/m0/s1InChIKey
PLQALGLXTNFLJE-CHQVSRGASA-NSynonyms
956955-45-6(12aS)6(24dimethoxyphenyl)2(furan2ylmethyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(24dimethoxyphenyl)2(furan2ylmethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(24dimethoxyphenyl)6(furan2ylmethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399755
956955456
COc1cc(OC)ccc1C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)Cc1ccco1
InChI=1SC27H25N3O5c1331691019(23(1216)342)262520(18734821(18)2825)132227(32)29(1524(31)30(22)26)141765113517h312222628H1315H212H3t2226?m0s1
MFCD04145479
ZINC000002158104
ZINC000002158110
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