Citroside A

CAS Registry Number®

120330-44-1

CAS Name

Citroside A

Molecular Formula

C19H30O8

Molecular Mass

386.44

Cite this Page

Citroside A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=120330-44-1 (retrieved 2025-02-24) (CAS RN: 120330-44-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H30O8/c1-10(21)5-6-13-18(2,3)7-11(22)8-19(13,4)27-17-16(25)15(24)14(23)12(9-20)26-17/h5,11-12,14-17,20,22-25H,7-9H2,1-4H3/t6-,11-,12+,14+,15-,16+,17-,19+/m0/s1

InChIKey

InChIKey=XTODSGVDHGMKSN-JAAWGWRJSA-N

SMILES

[C@@](=CC(C)=O)=C1[C@@](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)(C)C[C@@H](O)CC1(C)C

Canonical SMILES

O=C(C=C=C1C(OC2OC(CO)C(O)C(O)C2O)(C)CC(O)CC1(C)C)C

Other Names for this Substance

  • 3-Buten-2-one, 4-[(2R,4S)-2-(β-D-glucopyranosyloxy)-4-hydroxy-2,6,6-trimethylcyclohexylidene]-, (3R)-
  • 3-Buten-2-one, 4-[2-(β-D-glucopyranosyloxy)-4-hydroxy-2,6,6-trimethylcyclohexylidene]-, [2R-[1(R*),2α,4β]]-
  • (3R)-4-[(2R,4S)-2-(β-D-Glucopyranosyloxy)-4-hydroxy-2,6,6-trimethylcyclohexylidene]-3-buten-2-one
  • Citroside A

CAS INSIGHTSTM
Samples on a microarray, illustration