(1S,2S,3R,4Z,6Z,10S,12Z,14Z)-10-[(5S,6R,7R,8S,9S)-5,7-Dihydroxy-9-Methoxy-6,8-Dimethyldecan-2-Yl]-2,17-Dihydroxy-3,5,7-Trimethyl-9,19-Dioxabicyclo[16.1.0]Nonadeca-4,6,12,14-Tetraen-8-One
[CAS 142383-53-7]

Identification

• Name: (1S,2S,3R,4Z,6Z,10S,12Z,14Z)-10-[(5S,6R,7R,8S,9S)-5,7-Dihydroxy-9-Methoxy-6,8-Dimethyldecan-2-Yl]-2,17-Dihydroxy-3,5,7-Trimethyl-9,19-Dioxabicyclo[16.1.0]Nonadeca-4,6,12,14-Tetraen-8-One
• Synonyms: (1S,2S,3R,4Z,6Z,10S,12Z,14Z)-10-[(4S,5R,6R,7S,8S)-4,6-Dihydroxy-8-Methoxy-1,5,7-Trimethyl-Nonyl]-2,17-Dihydroxy-3,5,7-Trimethyl-9,19-Dioxabicyclo[16.1.0]Nonadeca-4,6,12,14-Tetraen-8-One; (1S,2S,3R,4Z,6Z,10S,12Z,14Z)-10-[(4S,5R,6R,7S,8S)-4,6-Dihydroxy-8-Methoxy-1,5,7-Trimethylnonyl]-2,17-Dihydroxy-3,5,7-Trimethyl-9,19-Dioxabicyclo[16.1.0]Nonadeca-4,6,12,14-Tetraen-8-One; (1S,2S,3R,4Z,6Z,10S,12Z,14Z)-10-[(5S,6R,7R,8S,9S)-5,7-Dihydroxy-9-Methoxy-6,8-Dimethyl-Decan-2-Yl]-2,17-Dihydroxy-3,5,7-Trimethyl-9,19-Dioxabicyclo[16.1.0]Nonadeca-4,6,12,14-Tetraen-8-One
• Molecular Formula: C₃₃H₅₄O₈
• Molecular Weight: 578.78
• CAS Registry Number: 142383-53-7
• SMILES: [C@@H]12OC1C(O)C\C=C/C=C\C[C@H](OC(=O)C(=C\C(=C/[C@H]([C@@H]2O)C)C)/C)C(CC[C@H](O)[C@H]([C@@H](O)[C@@H]([C@@H](OC)C)C)C)C
• InChI: 1S/C33H54O8/c1-19-17-21(3)29(36)32-31(41-32)27(35)13-11-9-10-12-14-28(40-33(38)22(4)18-19)20(2)15-16-26(34)24(6)30(37)23(5)25(7)39-8/h9-12,17-18,20-21,23-32,34-37H,13-16H2,1-8H3/b11-9-,12-10-,19-17-,22-18-/t20?,21-,23-,24-,25+,26+,27?,28+,29+,30+,31?,32+/m1/s1
• InChIKey: VOLRALTUADVHPT-QOKPVGNQSA-N

Properties

• Density: 1.071g/cm³ (Cal.)
• Boiling point: 749.537°C at 760 mmHg (Cal.)
• Flash point: 230.375°C (Cal.)