Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: EINECS 247-365-4
RN: 25955-03-7
InChIKey: KRRRXGPOQIUVMH-QEOBHVBUSA-N

Molecular Formula

  • C30-H40-O9

Molecular Weight

  • 544.637
 
* 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

Results Name

  • EINECS 247-365-4

Synonym

  • EINECS 247-365-4

Systematic Name

  • Bufa-4,20,22-trienolide, 3-((6-deoxy-alpha-l-mannopyranosyl)oxy)-14-hydroxy-19-oxo-, (3beta)-

Registry Numbers

CAS Registry Number

  • 25955-03-7

System Generated Number

  • 0025955037

Structure Descriptors

InChI

1S/C30H40O9/c1-16-24(33)25(34)26(35)27(38-16)39-19-7-11-29(15-31)18(13-19)4-5-22-21(29)8-10-28(2)20(9-12-30(22,28)36)17-3-6-23(32)37-14-17/h3,6,13-16,19-22,24-27,33-36H,4-5,7-12H2,1-2H3/t16-,19-,20+,21-,22+,24-,25+,26+,27-,28+,29+,30-/m0/s1

InChIKey

KRRRXGPOQIUVMH-QEOBHVBUSA-N

Smiles

C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CCC3=C2)C6=COC(=O)C=C6)[C@H](O)[C@H](O)[C@H]1O