(3aR,4R,6E,9S,10Z,11aR)-9-Acetoxy-6,10-Dimethyl-3-Methylene-2-Oxo-2,3,3A,4,5,8,9,11A-Octahydrocyclodeca[b]Furan-4-Yl (2E)-4-Hydroxy-2-(Hydroxymethyl)-2-Butenoate
[CAS# 38458-58-1]

Identification

• Name: (3aR,4R,6E,9S,10Z,11aR)-9-Acetoxy-6,10-Dimethyl-3-Methylene-2-Oxo-2,3,3A,4,5,8,9,11A-Octahydrocyclodeca[b]Furan-4-Yl (2E)-4-Hydroxy-2-(Hydroxymethyl)-2-Butenoate
• Synonyms: Hiyodorilactone A; C09475
• Molecular Formula: C₂₂H₂₈O₈
• Molecular Weight: 420.45
• CAS Registry Number: 38458-58-1
• SMILES: O=C/1O[C@@H]2\C=C(/[C@@H](OC(=O)C)C/C=C(/C[C@@H](OC(=O)/C(=C/CO)CO)[C@H]2C\1=C)C)C
• InChI: 1S/C22H28O8/c1-12-5-6-17(28-15(4)25)13(2)10-19-20(14(3)21(26)29-19)18(9-12)30-22(27)16(11-24)7-8-23/h5,7,10,17-20,23-24H,3,6,8-9,11H2,1-2,4H3/b12-5+,13-10-,16-7+/t17-,18+,19+,20+/m0/s1
• InChIKey: XYPJAWWDSQFSQA-RTZOPMFNSA-N

Properties

• Density: 1.263g/cm³ (Cal.)
• Boiling point: 618.874°C at 760 mmHg (Cal.)
• Flash point: 211.486°C (Cal.)