Paeonolide

CAS Registry Number®

72520-92-4

CAS Name

Paeonolide

Molecular Formula

C20H28O12

Molecular Mass

460.43

Cite this Page

Paeonolide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=72520-92-4 (retrieved 2024-11-24) (CAS RN: 72520-92-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H28O12/c1-8(21)10-4-3-9(28-2)5-12(10)31-20-18(27)16(25)15(24)13(32-20)7-30-19-17(26)14(23)11(22)6-29-19/h3-5,11,13-20,22-27H,6-7H2,1-2H3/t11-,13+,14-,15+,16-,17+,18+,19-,20+/m0/s1

InChIKey

InChIKey=IDZZECHGWAZTIB-NYBIBFQCSA-N

SMILES

O(C1=C(C(C)=O)C=CC(OC)=C1)[C@@H]2O[C@H](CO[C@H]3[C@H](O)[C@@H](O)[C@@H](O)CO3)[C@@H](O)[C@H](O)[C@H]2O

Canonical SMILES

O=C(C1=CC=C(OC)C=C1OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)C

Other Names for this Substance

  • Ethanone, 1-[2-[(6-O-α-L-arabinopyranosyl-β-D-glucopyranosyl)oxy]-4-methoxyphenyl]-
  • Glucopyranoside, 2-acetyl-5-methoxyphenyl O-α-L-arabinosyl-, β-D-
  • 1-[2-[(6-O-α-L-Arabinopyranosyl-β-D-glucopyranosyl)oxy]-4-methoxyphenyl]ethanone
  • Paeonolide

CAS INSIGHTSTM
Hourglass and a clock