Vitas-M small molecule compound
1-benzyl-3-(2,3,4,4a,6,6a,7,8,9,10b-decahydro-1H-benzo[c]chromen-6-yl)pyridinium
Catalog ID
STL147064
SMILES C1CC=C2C(C1)C(OC1C2CCCC1)c1ccc[n+](c1)Cc1ccccc1
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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 C25H30NO MW 360.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30NO/c1-2-9-19(10-3-1)17-26-16-8-11-20(18-26)25-23-14-5-4-12-21(23)22-13-6-7-15-24(22)27-25/h1-3,8-12,16,18,22-25H,4-7,13-15,17H2/q+1InChIKey
VGZDMJBYELSMKA-UHFFFAOYSA-NSynonyms
1benzyl3(2344a66a78910bdecahydro1Hbenzo(c)chromen6yl)pyridin1iumchloride
1benzyl3(2344a66a78910bdecahydro1Hbenzo(c)chromen6yl)pyridinium
3(2344a66a78910bdecahydro1Hbenzo(c)chromen6yl)1benzylpyridin1ium
C1CC=C2C(C1)C(OC1C2CCCC1)c1ccc(n+)(c1)Cc1ccccc1
C1CC=C2C(C1)C(OC1C2CCCC1)c1ccc(n+)(c1)Cc1ccccc1(Cl)
C1CCC2C(C1)C3=CCCCC3C(O2)C4=C(N+)(=CC=C4)CC5=CC=CC=C5
InChI=1SC25H30NOc12919(1031)17261681120(1826)252314541221(23)2213671524(22)2725h1381216182225H47131517H2q+1
MFCD00655112
ZINC000004587595
ZINC000004587600
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