Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Alaternin
RN: 39723-40-5
InChIKey: MQMTVWHXCSRCER-BZPRNGGBSA-N

Molecular Formula

  • C34-H42-O19

Molecular Weight

  • 754.6868
 
* 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

  • Alaternin (glycoside)
  • Catharticin
  • Rhamnocitrin 3-O-beta-D-rhamninoside

Systematic Names

  • 4H-1-Benzopyran-4-one, 3-((O-6-deoxy-alpha-L-mannopyranosyl-(1-3)-O-6-deoxy-alpha-L-mannopyranosyl-(1-6)-beta-D-galactopyranosyl)oxy)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-
  • Alaternin

Registry Numbers

CAS Registry Number

  • 39723-40-5

Other Registry Numbers

  • 39723-41-6
  • 71241-96-8

System Generated Number

  • 0039723405

Structure Descriptors

InChI

1S/C34H42O19/c1-11-20(37)24(41)26(43)33(49-11)52-30-21(38)12(2)48-32(28(30)45)47-10-18-22(39)25(42)27(44)34(51-18)53-31-23(40)19-16(36)8-15(46-3)9-17(19)50-29(31)13-4-6-14(35)7-5-13/h4-9,11-12,18,20-22,24-28,30,32-39,41-45H,10H2,1-3H3/t11-,12-,18+,20-,21-,22-,24+,25-,26+,27+,28+,30+,32+,33-,34-/m0/s1

InChIKey

MQMTVWHXCSRCER-BZPRNGGBSA-N

Smiles

COc1cc(O)c2C(=O)C(=C(Oc2c1)c3ccc(O)cc3)O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)[C@H]5O)[C@H](O)[C@H](O)[C@H]4O