(αR)-α-[(6-O-β-D-Xylopyranosyl-β-D-glucopyranosyl)oxy]benzeneacetic acid

CAS Registry Number®

190323-48-9

CAS Name

(αR)-α-[(6-O-β-D-Xylopyranosyl-β-D-glucopyranosyl)oxy]benzeneacetic acid

Molecular Formula

C19H26O12

Molecular Mass

446.40

Cite this Page

(αR)-α-[(6-O-β-D-Xylopyranosyl-β-D-glucopyranosyl)oxy]benzeneacetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=190323-48-9 (retrieved 2024-12-24) (CAS RN: 190323-48-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H26O12/c20-9-6-28-18(14(24)11(9)21)29-7-10-12(22)13(23)15(25)19(30-10)31-16(17(26)27)8-4-2-1-3-5-8/h1-5,9-16,18-25H,6-7H2,(H,26,27)/t9-,10-,11+,12-,13+,14-,15-,16-,18+,19+/m1/s1

InChIKey

InChIKey=DUZCTLMSDUOYAW-COVMKIEQSA-N

SMILES

O([C@@H](C(O)=O)C1=CC=CC=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(O)C(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)C=3C=CC=CC3

Other Names for this Substance

  • Benzeneacetic acid, α-[(6-O-β-D-xylopyranosyl-β-D-glucopyranosyl)oxy]-, (αR)-
  • (αR)-α-[(6-O-β-D-Xylopyranosyl-β-D-glucopyranosyl)oxy]benzeneacetic acid
  • Lucuminic acid

CAS INSIGHTSTM
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