(2E,10E,12E,16E,18E)-17-Ethyl-6-Hydroxy-3,5,7,9,11,15-Hexamethyl-8-Oxo-19-(6-Oxo-2,3-Dihydropyran-2-Yl)Nonadeca-2,10,12,16,18-Pentaenoic Acid
[CAS# 111278-00-3]

Identification

• Name: (2E,10E,12E,16E,18E)-17-Ethyl-6-Hydroxy-3,5,7,9,11,15-Hexamethyl-8-Oxo-19-(6-Oxo-2,3-Dihydropyran-2-Yl)Nonadeca-2,10,12,16,18-Pentaenoic Acid
• Synonyms: (2E,10E,12E,16E,18E)-17-Ethyl-6-Hydroxy-8-Keto-19-(6-Keto-2,3-Dihydropyran-2-Yl)-3,5,7,9,11,15-Hexamethyl-Nonadeca-2,10,12,16,18-Pentaenoic Acid; 2,10,12,16,18-Nonadecapentaenoic Acid, 19-(3,6-Dihydro-6-Oxo-2H-Pyran-2-Yl)-17-Ethyl-6-Hydroxy-3,5,7,9,11,15-Hexamethyl-8-Oxo-; Anguinomycin B
• Molecular Formula: C₃₂H₄₆O₆
• Molecular Weight: 526.71
• CAS Registry Number: 111278-00-3
• SMILES: C(C(C(O)C(C(=O)C(\C=C(\C=C\CC(/C=C(/C=C/C1OC(=O)C=CC1)CC)C)C)C)C)C)\C(=C\C(=O)O)C
• InChI: 1S/C32H46O6/c1-8-27(15-16-28-13-10-14-30(35)38-28)19-22(3)12-9-11-21(2)17-24(5)31(36)26(7)32(37)25(6)18-23(4)20-29(33)34/h9-11,14-17,19-20,22,24-26,28,32,37H,8,12-13,18H2,1-7H3,(H,33,34)/b11-9+,16-15+,21-17+,23-20+,27-19+
• InChIKey: QLEZOSIKJQCEQI-MVGWMUTRSA-N

Properties

• Density: 1.087g/cm³ (Cal.)
• Boiling point: 722.818°C at 760 mmHg (Cal.)
• Flash point: 226.078°C (Cal.)