(1S,2S,4Z,8Z,10S,12Z,14S)-2,10-Dihydroxy-4,8,12-Trimethyl-17-Methylidene-15-Oxabicyclo[12.3.0]Heptadeca-4,8,12-Trien-16-One
[CAS# 104992-90-7]

Identification

• Name: (1S,2S,4Z,8Z,10S,12Z,14S)-2,10-Dihydroxy-4,8,12-Trimethyl-17-Methylidene-15-Oxabicyclo[12.3.0]Heptadeca-4,8,12-Trien-16-One
• Synonyms: (1S,2S,4Z,8Z,10S,12Z,14S)-2,10-Dihydroxy-4,8,12-Trimethyl-17-Methylene-15-Oxabicyclo[12.3.0]Heptadeca-4,8,12-Trien-16-One; Cyclotetradeca(B)Furan-2(3H)-One, 3A,4,5,8,9,12,13,15A-Octahydro-4,12-Dihydroxy-6,10,14-Trimethyl-3-Methylene-, (3As-(3Ar*,4R*,6E,10E,12R*,14E,15Ar*))-; Kericembrenolide E
• Molecular Formula: C₂₀H₂₈O₄
• Molecular Weight: 332.44
• CAS Registry Number: 104992-90-7
• SMILES: [C@H]12[C@@H](OC(=O)C1=C)\C=C(C[C@H](O)\C=C(CC/C=C(C[C@@H]2O)/C)\C)\C
• InChI: 1S/C20H28O4/c1-12-6-5-7-13(2)10-17(22)19-15(4)20(23)24-18(19)11-14(3)9-16(21)8-12/h7-8,11,16-19,21-22H,4-6,9-10H2,1-3H3/b12-8-,13-7-,14-11-/t16-,17+,18+,19+/m1/s1
• InChIKey: KKAPMISEUVNCQQ-WOPUYNPLSA-N