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Substance Name: Penduline
RN: 26137-45-1
InChIKey: LKECRKCAEKJIGY-VMPREFPWSA-N

Note

  • A bisbenzylisoquinoline from Isopyrum thalictroides.

Molecular Formula

  • C37-H40-N2-O6

Molecular Weight

  • 608.731
 
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Names and Synonyms

Results Name

  • Penduline

Synonym

  • Penduline

Systematic Names

  • Berbaman-12-ol, 6,6',7-trimethoxy-2,2'-dimethyl-, (1beta)-
  • Penduline (Cocculus)

Registry Numbers

CAS Registry Number

  • 26137-45-1

System Generated Number

  • 0026137451

Structure Descriptors

InChI

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

InChIKey

LKECRKCAEKJIGY-VMPREFPWSA-N

Smiles

c1(O)ccc2C[C@H]3c4c(c(c(cc4CC[N@@]3C)OC)OC)Oc3cc4c(cc3OC)CC[N@@](C)[C@H]4Cc3cccc(c3)Oc1c2