(3R)-4-[(2R,4S)-4-[(6-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-2-hydroxy-2,6,6-trimethylcyclohexylidene]-3-buten-2-one

CAS Registry Number®

108567-70-0

CAS Name

(3R)-4-[(2R,4S)-4-[(6-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-2-hydroxy-2,6,6-trimethylcyclohexylidene]-3-buten-2-one

Molecular Formula

C24H38O12

Molecular Mass

518.55

Cite this Page

(3R)-4-[(2R,4S)-4-[(6-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-2-hydroxy-2,6,6-trimethylcyclohexylidene]-3-buten-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=108567-70-0 (retrieved 2024-11-12) (CAS RN: 108567-70-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C24H38O12/c1-12(26)5-6-15-22(2,3)7-13(8-23(15,4)31)35-20-18(29)17(28)16(27)14(36-20)9-33-21-19(30)24(32,10-25)11-34-21/h5,13-14,16-21,25,27-32H,7-11H2,1-4H3

InChIKey

InChIKey=WGFLJEFKPRMWSU-UHFFFAOYSA-N

SMILES

C(=CC(C)=O)=C1C(C)(C)CC(OC2OC(COC3C(O)C(CO)(O)CO3)C(O)C(O)C2O)CC1(C)O

Canonical SMILES

O=C(C=C=C1C(O)(C)CC(OC2OC(COC3OCC(O)(CO)C3O)C(O)C(O)C2O)CC1(C)C)C

Other Names for this Substance

  • 3-Buten-2-one, 4-[(2R,4S)-4-[(6-O-D-apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-2-hydroxy-2,6,6-trimethylcyclohexylidene]-, (3R)-
  • 3-Buten-2-one, 4-[4-[(6-O-D-apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-2-hydroxy-2,6,6-trimethylcyclohexylidene]-, [2R-(1R*,2α,4β)]-
  • (3R)-4-[(2R,4S)-4-[(6-O-D-Apio-β-D-furanosyl-β-D-glucopyranosyl)oxy]-2-hydroxy-2,6,6-trimethylcyclohexylidene]-3-buten-2-one
  • Cinnamoside

CAS INSIGHTSTM
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