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Substance Name: Dinklacorine
RN: 60579-86-4
InChIKey: MMGBHVBJOIKWMF-WUFINQPMSA-N

Molecular Formula

  • C36-H36-N2-O5

Molecular Weight

  • 576.689
 
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Names and Synonyms

Results Name

  • Dinklacorine

Synonyms

  • Dinklacorin
  • O12-Demethyl-O12'-methyltiliacorine

Systematic Name

  • Rodiasine, 6',7-didemethoxy-O12-demethyl-6',7-epoxy-O12'-methyl-, (1alpha,1'alpha)-

Registry Numbers

CAS Registry Number

  • 60579-86-4

System Generated Number

  • 0060579864

Structure Descriptors

InChI

1S/C36H36N2O5/c1-37-11-9-22-17-31-32-19-24(22)27(37)15-21-6-8-30(40-3)26(14-21)25-13-20(5-7-29(25)39)16-28-34-23(10-12-38(28)2)18-33(41-4)35(42-31)36(34)43-32/h5-8,13-14,17-19,27-28,39H,9-12,15-16H2,1-4H3/t27-,28+/m0/s1

InChIKey

MMGBHVBJOIKWMF-WUFINQPMSA-N

Smiles

c1cc(c2cc1C[C@@H]1c3c4Oc5cc6[C@H](Cc7ccc(OC)c2c7)[N@@](CCc6cc5Oc4c(cc3CC[N@@]1C)OC)C)O