Estriol 3,16a,17b-triacetate
[CAS# 2284-32-4]

Identification

• Name: Estriol 3,16a,17b-triacetate
• Synonyms: [(17R)-3,16-Diacetoxy-13-Methyl-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl] Acetate; Acetic Acid [(17R)-3,16-Diacetoxy-13-Methyl-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl] Ester; [(17R)-3,16-Diacetyloxy-13-Methyl-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl] Ethanoate
• Molecular Formula: C₂₄H₃₀O₆
• Molecular Weight: 414.50
• CAS Registry Number: 2284-32-4
• SMILES: [C@@H]4(OC(=O)C)C3(C(C1C(C2=C(CC1)C=C(OC(=O)C)C=C2)CC3)CC4OC(=O)C)C
• InChI: 1S/C24H30O6/c1-13(25)28-17-6-8-18-16(11-17)5-7-20-19(18)9-10-24(4)21(20)12-22(29-14(2)26)23(24)30-15(3)27/h6,8,11,19-23H,5,7,9-10,12H2,1-4H3/t19?,20?,21?,22?,23-,24?/m0/s1
• InChIKey: DKZPDNPWKHTWCC-AXXJUBEHSA-N

Properties

• Density: 1.222g/cm³ (Cal.)
• Boiling point: 509.477°C at 760 mmHg (Cal.)
• Flash point: 218.895°C (Cal.)