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O-Methylfagaronine
[CAS# 54785-54-5]

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CAS#: 54785-54-5
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Identification
Name O-Methylfagaronine
Synonyms 2,3,8,9-Tetramethoxy-5-Methyl-Benzo[C]Phenanthridin-5-Ium Chloride; Benzo(C)Phenanthridinium, 5-Methyl-2,3,8,9-Tetramethoxy-, Chloride, Trihydrate; O-Methylfagaronine Chloride Trihydrate
Molecular Structure CAS#: 54785-54-5, O-Methylfagaronine
Molecular Formula C22H22ClNO4
Molecular Weight 399.87
CAS Registry Number 54785-54-5
SMILES C1=[N+](C3=C(C2=CC(=C(OC)C=C12)OC)C=CC4=CC(=C(OC)C=C34)OC)C.[Cl-]
InChI 1S/C22H22NO4.ClH/c1-23-12-14-9-19(25-3)20(26-4)10-16(14)15-7-6-13-8-18(24-2)21(27-5)11-17(13)22(15)23;/h6-12H,1-5H3;1H/q+1;/p-1
InChIKey STJJMCOJNXLYFW-UHFFFAOYSA-M
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