(1R,2R)-2-Hydroxy-2-(2-Hydroxyethyl)-5-[(2E,4E,6E,8E)-2,6,8-Trimethyl-9-(2-Oxo-5H-Furan-3-Yl)Nona-2,4,6,8-Tetraenoyl]-6-Oxa-3-Azabicyclo[3.1.0]Hexan-4-One
[CAS 145763-35-5]

Identification

• Name: (1R,2R)-2-Hydroxy-2-(2-Hydroxyethyl)-5-[(2E,4E,6E,8E)-2,6,8-Trimethyl-9-(2-Oxo-5H-Furan-3-Yl)Nona-2,4,6,8-Tetraenoyl]-6-Oxa-3-Azabicyclo[3.1.0]Hexan-4-One
• Synonyms: (1R,2R)-2-Hydroxy-2-(2-Hydroxyethyl)-5-[(2E,4E,6E,8E)-2,6,8-Trimethyl-1-Oxo-9-(2-Oxo-5H-Furan-3-Yl)Nona-2,4,6,8-Tetraenyl]-6-Oxa-3-Azabicyclo[3.1.0]Hexan-4-One; (1R,2R)-2-Hydroxy-2-(2-Hydroxyethyl)-5-[(2E,4E,6E,8E)-9-(2-Keto-5H-Furan-3-Yl)-2,6,8-Trimethyl-Nona-2,4,6,8-Tetraenoyl]-6-Oxa-3-Azabicyclo[3.1.0]Hexan-4-One; 6-Oxa-3-Azabicyclo(3.1.0)Hexan-2-One, 1-(9-(2,5-Dihydro-2-Oxo-3-Furanyl)-2,6,8-Trimethyl-1-Oxo-2,4,6,8-Nonatetraenyl)-4-Hydroxy-4-(2-Hydroxyethyl)-, (1R-(1Alpha(2E,4E,6E,8E),4Alpha,5Alpha))-
• Molecular Formula: C₂₂H₂₅NO₇
• Molecular Weight: 415.44
• CAS Registry Number: 145763-35-5
• SMILES: [C@@H]12OC1(C(=O)N[C@@]2(O)CCO)C(=O)C(=C/C=C/C(=C/C(=C/C3=CCOC3=O)C)C)/C
• InChI: 1S/C22H25NO7/c1-13(11-14(2)12-16-7-10-29-18(16)26)5-4-6-15(3)17(25)22-19(30-22)21(28,8-9-24)23-20(22)27/h4-7,11-12,19,24,28H,8-10H2,1-3H3,(H,23,27)/b5-4+,13-11+,14-12+,15-6+/t19-,21+,22?/m0/s1
• InChIKey: MMGAZADGXNYOGJ-OCHUWBEOSA-N

Properties

• Density: 1.393g/cm³ (Cal.)
• Boiling point: 784.338°C at 760 mmHg (Cal.)
• Flash point: 428.152°C (Cal.)