[(3aR,4R,6E,9R,10E,11aR)-9-Hydroxy-6,10-Dimethyl-3-Methylidene-2-Oxo-3a,4,5,8,9,11a-Hexahydrocyclodeca[b]Furan-4-Yl] (Z)-2-(Hydroxymethyl)But-2-Enoate
[CAS# 38456-39-2]

Identification

• Classification: Natural product >> Sesquiter
• Name: [(3aR,4R,6E,9R,10E,11aR)-9-Hydroxy-6,10-Dimethyl-3-Methylidene-2-Oxo-3a,4,5,8,9,11a-Hexahydrocyclodeca[b]Furan-4-Yl] (Z)-2-(Hydroxymethyl)But-2-Enoate
• Synonyms: [(3Ar,4R,6E,9R,10E,11Ar)-9-Hydroxy-6,10-Dimethyl-3-Methylene-2-Oxo-3A,4,5,8,9,11A-Hexahydrocyclodeca[B]Furan-4-Yl] (Z)-2-(Hydroxymethyl)But-2-Enoate; (Z)-2-(Hydroxymethyl)But-2-Enoic Acid [(3Ar,4R,6E,9R,10E,11Ar)-9-Hydroxy-6,10-Dimethyl-3-Methylene-2-Oxo-3A,4,5,8,9,11A-Hexahydrocyclodeca[B]Furan-4-Yl] Ester; (Z)-2-Methylolbut-2-Enoic Acid [(3Ar,4R,6E,9R,10E,11Ar)-9-Hydroxy-2-Keto-6,10-Dimethyl-3-Methylene-3A,4,5,8,9,11A-Hexahydrocyclodeca[D]Furan-4-Yl] Ester
• Molecular Formula: C₂₀H₂₆O₆
• Molecular Weight: 362.42
• CAS Registry Number: 38456-39-2
• SMILES: [C@@H]12[C@H](OC(=O)C(/CO)=C\C)CC(=C/C[C@@H](O)/C(=C/[C@H]1OC(=O)C2=C)C)/C
• InChI: 1S/C20H26O6/c1-5-14(10-21)20(24)26-16-8-11(2)6-7-15(22)12(3)9-17-18(16)13(4)19(23)25-17/h5-6,9,15-18,21-22H,4,7-8,10H2,1-3H3/b11-6+,12-9+,14-5-/t15-,16-,17-,18-/m1/s1
• InChIKey: WQBVXCQSQYBGGT-OPDDCXCPSA-N

Properties

• Density: 1.217g/cm³ (Cal.)
• Boiling point: 574.449°C at 760 mmHg (Cal.)
• Flash point: 201.543°C (Cal.)