[2,3-Dimethyl-6-(3,6,9-Trihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,11,12,14,15,16,17-Tetradecahydrocyclopenta[a]Phenanthren-17-Yl)Heptan-2-Yl] Acetate
[CAS# 110325-83-2]

Identification

• Name: [2,3-Dimethyl-6-(3,6,9-Trihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,11,12,14,15,16,17-Tetradecahydrocyclopenta[a]Phenanthren-17-Yl)Heptan-2-Yl] Acetate
• Synonyms: [1,1,2-Trimethyl-5-(3,6,9-Trihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,11,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl)Hexyl] Acetate; Acetic Acid [1,1,2-Trimethyl-5-(3,6,9-Trihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,11,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl)Hexyl] Ester; [2,3-Dimethyl-6-(3,6,9-Trihydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,11,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-17-Yl)Heptan-2-Yl] Ethanoate
• Molecular Formula: C₃₀H₅₂O₅
• Molecular Weight: 492.74
• CAS Registry Number: 110325-83-2
• SMILES: C(C(C(OC(=O)C)(C)C)C)CC(C4C3(CCC2(C1(C(CC(CC1)O)C(CC2C3CC4)O)C)O)C)C
• InChI: 1S/C30H52O5/c1-18(8-9-19(2)27(4,5)35-20(3)31)22-10-11-23-24-17-26(33)25-16-21(32)12-13-29(25,7)30(24,34)15-14-28(22,23)6/h18-19,21-26,32-34H,8-17H2,1-7H3
• InChIKey: DHQPGHFKCMJXKL-UHFFFAOYSA-N

Properties

• Density: 1.1g/cm³ (Cal.)
• Boiling point: 579.809°C at 760 mmHg (Cal.)
• Flash point: 177.087°C (Cal.)