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Substance Name: Nimbidinin
RN: 29803-86-9
InChIKey: MWPUYUVXTZFYJY-UHFFFAOYSA-N

Molecular Formula

  • C26-H34-06

Molecular Weight

  • 442.5486
 
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Names and Synonyms

Results Name

  • Nimbidinin

Synonyms

  • (1alpha,3alpha,4beta,5alpha,6beta,7alpha,17alpha)-21,23-Epoxy-4,5,5',6-tetrahydro-1,3,7-trihydroxy-4,8-dimethyl-24-norchola-5,14,20,22-tetraeno(6,5,4-bc)furan-12-one
  • 21,23-Epoxy-4,5,5',6-tetrahydro-1,3,7-trihydroxy-4,8-dimethyl-24-norchola-5,14,20,22-tetraeno(6,5,4-bc)furan-12-one (1alpha,3alpha,4beta,5alpha,6beta,7alpha,17alpha)-
  • Nimbidinin

Systematic Name

  • 24-Norchola-5,14,20,22-tetraeno(6,5,4-bc)furan-12-one, 21,23-epoxy-4,5,5',6-tetrahydro-1,3,7-trihydroxy-4,8-dimethyl-, (1alpha,3alpha,4beta,5alpha,6beta,7alpha,17alpha)-

Registry Numbers

CAS Registry Number

  • 29803-86-9

System Generated Number

  • 0029803869

Structure Descriptors

InChI

1S/C26H34O6/c1-23-12-32-20-21(23)26(4,19(29)10-17(23)27)16-9-18(28)24(2)14(13-7-8-31-11-13)5-6-15(24)25(16,3)22(20)30/h6-8,11,14,16-17,19-22,27,29-30H,5,9-10,12H2,1-4H3

InChIKey

MWPUYUVXTZFYJY-UHFFFAOYSA-N

Smiles

CC12COC3C1C(C(CC2O)O)(C4CC(=O)C5(C(CC=C5C4(C3O)C)c6ccoc6)C)C