Tedanolide
[CAS# 92471-87-9]

Identification

• Name: Tedanolide
• Synonyms: (3R,4S,5S,7R,8R,9Z,11S,14S,15R,17R)-3,8,14-Trihydroxy-17-[(S)-Hydroxy-[(2R,3R)-2-Methyl-3-[(Z,1S)-1-Methylbut-2-Enyl]Oxiran-2-Yl]Methyl]-4-Methoxy-5,7,9,11,15-Pentamethyl-1-Oxacyclooctadec-9-Ene-2,6,12,16-Tetrone; (3R,4S,5S,7R,8R,9Z,11S,14S,15R,17R)-3,8,14
• Molecular Formula: C₃₂H₅₀O₁₁
• Molecular Weight: 610.74
• CAS Registry Number: 92471-87-9
• SMILES: [C@]1(O[C@@H]1[C@H](\C=C/C)C)([C@@H](O)[C@@H]2C(=O)[C@@H]([C@@H](O)CC(=O)[C@H](\C=C(/[C@H](O)[C@H](C(=O)[C@H]([C@H](OC)[C@@H](O)C(OC2)=O)C)C)C)C)C)C
• InChI: 1S/C32H50O11/c1-10-11-15(2)30-32(8,43-30)29(39)21-14-42-31(40)27(38)28(41-9)20(7)25(36)19(6)24(35)17(4)12-16(3)22(33)13-23(34)18(5)26(21)37/h10-12,15-16,18-21,23-24,27-30,34-35,38-39H,13-14H2,1-9H3/b11-10-,17-12-/t15-,16-,18+,19+,20+,21-,23-,24-,27+,28-,2
• InChIKey: ILTUTLWVTBBXNS-OOKZJIOFSA-N

Properties

• Density: 1.216g/cm³ (Cal.)
• Boiling point: 780.656°C at 760 mmHg (Cal.)
• Flash point: 241.724°C (Cal.)