Salicylic acid phenolic glucuronide
CAS Registry Number®
7695-70-7
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CAS Name
Salicylic acid phenolic glucuronideMolecular Formula
C13H14O9Molecular Mass
314.24Cite this Page
Salicylic acid phenolic glucuronide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=7695-70-7 (retrieved ) (CAS RN: 7695-70-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
145-146 °C (decomp)
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C13H14O9/c14-7-8(15)10(12(19)20)22-13(9(7)16)21-6-4-2-1-3-5(6)11(17)18/h1-4,7-10,13-16H,(H,17,18)(H,19,20)/t7-,8-,9+,10-,13+/m0/s1
InChIKey
InChIKey=JSCWDKKMLIQCMR-CDHFTJPESA-N
SMILES
O([C@@H]1O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]1O)C2=C(C(O)=O)C=CC=C2
Canonical SMILES
O=C(O)C=1C=CC=CC1OC2OC(C(=O)O)C(O)C(O)C2O
Other Names for this Substance
- β-D-Glucopyranosiduronic acid, 2-carboxyphenyl
- Glucopyranosiduronic acid, o-carboxyphenyl, β-D-
- β-D-Glucopyranosiduronic acid, o-carboxyphenyl
- 2-Carboxyphenyl β-D-glucopyranosiduronic acid
- Salicyl phenolic glucuronide
Deleted or Replaced CAS Registry Numbers
96750-93-5, 7696-34-6, 31046-21-6, 31566-22-0
