Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 17-(4-Bromobenzoyloxy)-9,11-epoxy-7-hydroxybeyerene
RN: 134513-16-9
InChIKey: XRJFRXRBPQBNOI-UWNSIUDESA-N

Molecular Formula

  • C27-H33-Br-O4

Molecular Weight

  • 501.4577
 
* 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

Name of Substance

  • 17-(4-Bromobenzoyloxy)-9,11-epoxy-7-hydroxybeyerene

Synonyms

  • 17-(4-Bromobenzoyloxy)-9beta,11beta-epoxy-7beta-hydroxy-ent-beyerene
  • 17-Bbehb

Systematic Name

  • 17-Norkaur-15-ene-13, methanol, 9,11-epoxy-7-hydroxy-, alpha-(4-bromobenzoate), (7beta,8beta,11beta,13beta)-

Registry Numbers

CAS Registry Number

  • 134513-16-9

System Generated Number

  • 0134513169

Structure Descriptors

InChI

1S/C27H33BrO4/c1-23(2)9-4-10-24(3)19(23)13-20(29)26-12-11-25(15-26,14-21-27(24,26)32-21)16-31-22(30)17-5-7-18(28)8-6-17/h5-8,11-12,19-21,29H,4,9-10,13-16H2,1-3H3/t19-,20+,21+,24-,25+,26?,27-/m1/s1

InChIKey

XRJFRXRBPQBNOI-UWNSIUDESA-N

Smiles

C[C@@]12CCCC([C@H]1C[C@@H](C34[C@@]25[C@@H](O5)C[C@](C3)(C=C4)COC(=O)c6ccc(cc6)Br)O)(C)C