Retinylglucuronide
[CAS# 16639-19-3]

Identification

• Name: Retinylglucuronide
• Synonyms: (2S,3S,4S,5R,6R)-6-[(2Z,4E,6Z,8E)-3,7-Dimethyl-9-(2,6,6-Trimethyl-1-Cyclohexenyl)Nona-2,4,6,8-Tetraenoxy]-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6R)-6-[(2Z,4E,6Z,8E)-3,7-Dimethyl-9-(2,6,6-Trimethyl-1-Cyclohexenyl)Nona-2,4,6,8-Tetraenoxy]-3,4,5-Trihydroxy-2-Tetrahydropyrancarboxylic Acid; (2S,3S,4S,5R,6R)-6-[(2Z,4E,6Z,8E)-3,7-Dimethyl-9-(2,6,6-Trimethyl-1-Cyclohexenyl)Nona-2,4,6,8-Tetraenoxy]-3,4,5-Trihydroxy-Oxane-2-Carboxylic Acid
• Molecular Formula: C₂₆H₃₈O₇
• Molecular Weight: 462.58
• CAS Registry Number: 16639-19-3
• SMILES: [C@@H]2(O[C@@H](OC/C=C(\C=C\C=C(/C=C/C1=C(CCCC1(C)C)C)C)C)[C@H](O)[C@@H](O)[C@@H]2O)C(=O)O
• InChI: 1S/C26H38O7/c1-16(11-12-19-18(3)10-7-14-26(19,4)5)8-6-9-17(2)13-15-32-25-22(29)20(27)21(28)23(33-25)24(30)31/h6,8-9,11-13,20-23,25,27-29H,7,10,14-15H2,1-5H3,(H,30,31)/b9-6+,12-11+,16-8-,17-13-/t20-,21-,22+,23-,25+/m0/s1
• InChIKey: IYHVRAMISWFIRU-GMBUFXMQSA-N

Properties

• Density: 1.202g/cm³ (Cal.)
• Boiling point: 659.724°C at 760 mmHg (Cal.)
• Flash point: 216.362°C (Cal.)