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Substance Name: Pakistanine
RN: 36506-69-1
InChIKey: PJBCPYBIOOFQBE-URLMMPGGSA-N

Note

  • Dimeric alkaloid isolated from Berberis baluchistanica Ahrendt (Berberidaceae).

Molecular Weight

  • 608.731
 
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Names and Synonyms

Name of Substance

  • Pakistanine

Systematic Name

  • 4H-Dibenzo(de,g)quinoline-1,10-diol, 5,6,6a,7-tetrahydro-2-methoxy-6-methyl-9-(4-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl)phenoxy)-, (R-(R*,S*))-

Registry Numbers

CAS Registry Number

  • 36506-69-1

System Generated Number

  • 0036506691

Structure Descriptors

InChI

1S/C37H40N2O6/c1-38-12-10-22-16-32(42-3)33(43-4)20-26(22)28(38)14-21-6-8-25(9-7-21)45-31-18-24-15-29-35-23(11-13-39(29)2)17-34(44-5)37(41)36(35)27(24)19-30(31)40/h6-9,16-20,28-29,40-41H,10-15H2,1-5H3/t28-,29+/m0/s1

InChIKey

PJBCPYBIOOFQBE-URLMMPGGSA-N

Smiles

C1[N@@]([C@@H]2Cc3c(c4c2c(C1)cc(c4O)OC)cc(c(c3)Oc1ccc(cc1)C[C@@H]1[N@@](CCc2cc(c(cc12)OC)OC)C)O)C