Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Toxiferine I, 4,4'-didemethyl-8-deoxy-
RN: 67739-70-2
InChIKey: OTZPNRYBSMNTJD-NJSZIWMXSA-N

Molecular Formula

  • C38-H40-N4-O

Molecular Weight

  • 568.761
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 4,4'-Didemethyk-8-deoxytoxiferine I
  • Bisnor-C-alkaloid H

Systematic Name

  • Toxiferine I, 4,4'-didemethyl-8-deoxy-

Registry Numbers

CAS Registry Number

  • 67739-70-2

System Generated Number

  • 0067739702

Structure Descriptors

InChI

1S/C38H40N4O/c1-2-23-19-39-14-12-37-29-7-3-6-10-32(29)42-22-28-26-18-34-38(13-15-40(34)20-24(26)11-16-43)30-8-4-5-9-31(30)41(36(28)38)21-27(35(37)42)25(23)17-33(37)39/h2-11,21-22,25-26,33-36,43H,12-20H2,1H3/b23-2-,24-11-,27-21-,28-22-

InChIKey

OTZPNRYBSMNTJD-NJSZIWMXSA-N

Smiles

C(\CO)=C1\C[N@@]2CC[C@@]34c5c(cccc5)N5C=C6[C@@H]7N(C=C([C@@H]1C[C@@H]24)[C@@H]35)c1c([C@@]27[C@@H]3C[C@@H]6C(\C[N@@]3CC2)=C\C)cccc1