Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 6-Feruloylcatalpol
RN: 125205-48-3
InChIKey: RMSKZOXJAHOIER-UUNVNYOPSA-N

Molecular Formula

  • C25-H30-O12

Molecular Weight

  • 538.499
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • 6-Feruloylcatalpol

Synonym

  • 6-O-trans-Feruloylcatalpol

Systematic Name

  • beta-D-Glucopyranoside, 1a,1b,2,5a,6,6a-hexahydro-6-(((2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl)oxy)-1a- (hydroxymethyl)oxireno(4,5)cyclopenta(1,2-c)pyran-2-yl, (1aS,1bS,2S,5aR,6S,6aS)-

Registry Numbers

CAS Registry Number

  • 125205-48-3

Other Registry Number

  • 150620-34-1

System Generated Number

  • 0125205483

Structure Descriptors

InChI

1S/C25H30O13/c1-33-14-8-11(2-4-13(14)28)3-5-16(29)36-21-12-6-7-34-23(17(12)25(10-27)22(21)38-25)37-24-20(32)19(31)18(30)15(9-26)35-24/h2-8,12,15,17-24,26-28,30-32H,9-10H2,1H3/b5-3+/t12-,15+,17-,18+,19-,20+,21+,22+,23+,24-,25-/m1/s1

InChIKey

RMSKZOXJAHOIER-UUNVNYOPSA-N

Smiles

COc1cc(\C=C\C(=O)O[C@H]2[C@@H]3C=CO[C@@H](O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H]3[C@@]5(CO)O[C@@H]25)ccc1O