12-Deoxyphorbol-13-Angelate
[CAS# 65700-60-9]

Identification

• Name: 12-Deoxyphorbol-13-Angelate
• Synonyms: 5H-Cyclopropa(3,4)Benz(1,2-E)Azulen-5-One, 1,1A-Alpha,1B-Beta,4,4A,7A-Alpha,7B,8,9,9A-Decahydro-4A-Beta,7B-Alpha,9A-Alpha-Trihydroxy-3-(Hydroxymethyl)-1,1,6,8-Alpha-Tetramethyl-, 9A-(2-Methylcrotonate)
• Molecular Formula: C₂₅H₃₄O₆
• Molecular Weight: 430.54
• CAS Registry Number: 65700-60-9
• SMILES: [C@@]24([C@H]([C@@H]1C=C(C[C@]3([C@H]([C@]1([C@@H](C2)C)O)C=C(C)C3=O)O)CO)C4(C)C)OC(C(=C/C)\C)=O
• InChI: 1S/C25H34O6/c1-7-13(2)21(28)31-24-10-15(4)25(30)17(19(24)22(24,5)6)9-16(12-26)11-23(29)18(25)8-14(3)20(23)27/h7-9,15,17-19,26,29-30H,10-12H2,1-6H3/b13-7-/t15-,17+,18-,19-,23-,24+,25-/m1/s1
• InChIKey: GFAGCYRBGVCTPP-APZZYBINSA-N

Properties

• Density: 1.271g/cm³ (Cal.)
• Boiling point: 584.043°C at 760 mmHg (Cal.)
• Flash point: 194.268°C (Cal.)