1-O-Palmitylglucuronic Acid
[CAS# 17460-02-5]

Identification

• Name: 1-O-Palmitylglucuronic Acid
• Synonyms: (2S,3S,4S,5R,6R)-6-Hexadecoxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6R)-6-Hexadecoxy-3,4,5-Trihydroxy-2-Tetrahydropyrancarboxylic Acid; (2S,3S,4S,5R,6R)-6-Cetyloxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid
• Molecular Formula: C₂₂H₄₂O₇
• Molecular Weight: 418.57
• CAS Registry Number: 17460-02-5
• SMILES: [C@H]1(OCCCCCCCCCCCCCCCC)[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(=O)O
• InChI: 1S/C22H42O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-28-22-19(25)17(23)18(24)20(29-22)21(26)27/h17-20,22-25H,2-16H2,1H3,(H,26,27)/t17-,18-,19+,20-,22+/m0/s1
• InChIKey: QFUQXEVPTHAOHS-SXFAUFNYSA-N

Properties

• Density: 1.123g/cm³ (Cal.)
• Boiling point: 575.919°C at 760 mmHg (Cal.)
• Flash point: 188.38°C (Cal.)