Spiraein

CAS Registry Number®

14907-56-3

CAS Name

Spiraein

Molecular Formula

C18H24O11

Molecular Mass

416.38

Cite this Page

Spiraein.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=14907-56-3 (retrieved 2024-12-27) (CAS RN: 14907-56-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H24O11/c19-5-8-3-1-2-4-10(8)28-18-16(25)14(23)13(22)11(29-18)7-27-17-15(24)12(21)9(20)6-26-17/h1-5,9,11-18,20-25H,6-7H2/t9-,11-,12+,13-,14+,15-,16-,17+,18-/m1/s1

InChIKey

InChIKey=DSDFXGQRZAFFQA-ZCLRWAROSA-N

SMILES

O([C@@H]1O[C@H](CO[C@H]2[C@H](O)[C@@H](O)[C@H](O)CO2)[C@@H](O)[C@H](O)[C@H]1O)C3=C(C=O)C=CC=C3

Canonical SMILES

O=CC=1C=CC=CC1OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O

Other Names for this Substance

  • Benzaldehyde, 2-[(6-O-β-D-xylopyranosyl-β-D-glucopyranosyl)oxy]-
  • Glucopyranoside, o-formylphenyl 6-O-β-D-xylopyranosyl, β-D
  • 2-[(6-O-β-D-Xylopyranosyl-β-D-glucopyranosyl)oxy]benzaldehyde
  • Spiraein (Filipendula)
  • Spiraein

CAS INSIGHTSTM
Pile of blue, green, and white color of capsule pills with modern design light.