Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Glycyrrhetyl 30-monoglucuronide
RN: 111510-20-4
InChIKey: PCQOITPWNKCXLU-KFRHEUMDSA-N

Molecular Formula

  • C36-H54-O10

Molecular Weight

  • 646.8126
 
* 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

  • Glycyrrhetyl 30-monoglucuronide

Synonym

  • 1-(18beta-Glycyrrhet-30-yl)glucopyranuronic acid

Systematic Name

  • beta-D-Glucopyranuronic acid, 1-((3beta,20beta)-3-hydroxy-11-oxoolean-12-en-29-oate)

Registry Numbers

CAS Registry Number

  • 111510-20-4

System Generated Number

  • 0111510204

Structure Descriptors

InChI

1S/C36H54O10/c1-31(2)21-8-11-36(7)27(34(21,5)10-9-22(31)38)20(37)16-18-19-17-33(4,13-12-32(19,3)14-15-35(18,36)6)30(44)46-29-25(41)23(39)24(40)26(45-29)28(42)43/h16,19,21-27,29,38-41H,8-15,17H2,1-7H3,(H,42,43)/t19-,21?,22+,23+,24+,25-,26+,27?,29+,32-,33-,34+,35-,36-/m1/s1

InChIKey

PCQOITPWNKCXLU-KFRHEUMDSA-N

Smiles

C[C@]12CC[C@@](C[C@@H]1C3=CC(=O)C4[C@]5(CC[C@@H](C(C5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)(C)C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O