Phorbol monoacetate monolaurate
[CAS# 16675-05-1]

Identification

• Name: Phorbol monoacetate monolaurate
• Synonyms: Phorbol Monoacetate Monolaurate; Brn 2610948; Lauric Acid, 9A-Ester With 1,1A-Alpha,1B-Beta,4,4A,7A-Alpha,7B,8,9,9A-Decahydro-3-(Hydroxymethyl)-4A-Beta,7B-Alpha,9-Beta,9A-Alpha-Tetrahydroxy-1,1,6,8-Alpha-Tetramethyl-5H-Cyclopropa(3,4)Benz(1,2-E)Azulen-5-One 9-Acetate
• Molecular Formula: C₃₄H₅₂O₈
• Molecular Weight: 588.78
• CAS Registry Number: 16675-05-1
• SMILES: [C@H]12[C@](OC(=O)CCCCCCCCCCC)(C1(C)C)C(OC(=O)C)[C@H]([C@@]3(O)[C@H]2C=C(C[C@@]4(O)[C@H]3C=C(C4=O)C)CO)C
• InChI: 1S/C34H52O8/c1-7-8-9-10-11-12-13-14-15-16-27(37)42-34-28(31(34,5)6)25-18-24(20-35)19-32(39)26(17-21(2)29(32)38)33(25,40)22(3)30(34)41-23(4)36/h17-18,22,25-26,28,30,35,39-40H,7-16,19-20H2,1-6H3/t22-,25+,26-,28-,30?,32-,33-,34-/m1/s1
• InChIKey: PSBLORXWXFKGFT-XBQQKYDNSA-N

Properties

• Density: 1.193g/cm³ (Cal.)
• Boiling point: 679.695°C at 760 mmHg (Cal.)
• Flash point: 205.84°C (Cal.)