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Substance Name: Phaeanthrine
RN: 27670-80-0
InChIKey: IWKHGZDMTOKGQP-UHFFFAOYSA-N

Note

  • Isoquinoline alkaloid from Phillipine medicinal tree Phaeanthus ebracteolatus (kalimatas tree).

Molecular Formula

  • C39-H40-N2-O6

Molecular Weight

  • 632.753
 
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Names and Synonyms

Name of Substance

  • Phaeanthrine

Synonym

  • Phaeantharine chloride

Systematic Name

  • Isoquinolinium, 1-((4-(5-((6,7-dimethoxy-2-methylisoquinolinium-1-yl)methyl)-2-methoxyphenoxy)phenyl)methyl)-6,7-dimethoxy-2-methyl-

Registry Numbers

CAS Registry Number

  • 27670-80-0

System Generated Number

  • 0027670800

Structure Descriptors

InChI

1S/C39H40N2O6/c1-40-16-14-27-21-35(43-4)37(45-6)23-30(27)32(40)18-25-8-11-29(12-9-25)47-39-20-26(10-13-34(39)42-3)19-33-31-24-38(46-7)36(44-5)22-28(31)15-17-41(33)2/h8-17,20-24H,18-19H2,1-7H3/q+2

InChIKey

IWKHGZDMTOKGQP-UHFFFAOYSA-N

Smiles

c1([n+](ccc2cc(c(cc12)OC)OC)C)Cc1ccc(cc1)Oc1c(ccc(c1)Cc1[n+](ccc2cc(c(cc12)OC)OC)C)OC