Phorbol 13,20-Diacetate
[CAS# 41621-85-6]

Identification

• Name: Phorbol 13,20-Diacetate
• Synonyms: 5H-Cyclopropa(3,4)Benz(1,2-E)Azulen-5-One, 9A-(Acetyloxy)-3-((Acetyloxy)Methyl)-1,1A,1B,4,4A,7A,7B,8,9,9A-Decahydro-4A,7B,9-Trihydroxy-1,1,6,8-Tetramethyl-, (1Ar-(1Aalpha,1Bbeta,4Abeta,7Aalpha,7Balpha,8Alpha,9Beta,9Aalpha))-; Phorbol 13,20-Diacetate
• Molecular Formula: C₂₄H₃₂O₈
• Molecular Weight: 448.51
• CAS Registry Number: 41621-85-6
• SMILES: [C@H]12[C@](OC(=O)C)(C1(C)C)[C@H](O)[C@H]([C@@]3(O)[C@H]2C=C(C[C@@]4(O)[C@H]3C=C(C4=O)C)COC(=O)C)C
• InChI: 1S/C24H32O8/c1-11-7-17-22(29,19(11)27)9-15(10-31-13(3)25)8-16-18-21(5,6)24(18,32-14(4)26)20(28)12(2)23(16,17)30/h7-8,12,16-18,20,28-30H,9-10H2,1-6H3/t12-,16+,17-,18-,20-,22-,23-,24-/m1/s1
• InChIKey: VCQRVYCLJARKLE-XQOWHXTBSA-N

Properties

• Density: 1.347g/cm³ (Cal.)
• Boiling point: 583.283°C at 760 mmHg (Cal.)
• Flash point: 194.438°C (Cal.)