Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 5-beta-Card-20(22)-enolide, 3-beta,12-beta,14,16-tetrahydroxy-, 16-acetate
RN: 102281-00-5
InChIKey: BOMSEUWJUZCEOA-VENYRCEESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H36-O7

Molecular Weight

  • 448.552
 
* 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

  • 16-Monoacetyldiginatigenin
  • 3-beta,12-beta,14,16-Tetrahydroxy-5-beta-card-20(22)-enolide 16-acetate
  • BRN 1670073

Systematic Name

  • 5-beta-Card-20(22)-enolide, 3-beta,12-beta,14,16-tetrahydroxy-, 16-acetate

Registry Numbers

CAS Registry Number

  • 102281-00-5

System Generated Number

  • 0102281005

Structure Descriptors

InChI

1S/C25H36O7/c1-13(26)32-19-11-25(30)17-5-4-15-9-16(27)6-7-23(15,2)18(17)10-20(28)24(25,3)22(19)14-8-21(29)31-12-14/h8,15-20,22,27-28,30H,4-7,9-12H2,1-3H3/t15-,16+,17?,18?,19?,20-,22+,23+,24-,25+/m1/s1

InChIKey

BOMSEUWJUZCEOA-VENYRCEESA-N

Smiles

C1[C@@]2([C@@]([C@H](C=3COC(C3)=O)[C@@H]1OC(C)=O)([C@@H](C[C@@H]1[C@@H]2CC[C@H]2[C@@]1(CC[C@@H](C2)O)C)O)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
pigeon LDLo parenteral 1840ug/kg (1.84mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 8, Pg. 535, 1960.