10-Hydroxy-2,4a,6a,8a,9,14a-Hexamethyl-11-Oxo-1,3,4,5,6,6a,6b,7,8,13,14,14b-Dodecahydropicene-2-Carboxylic Acid
[CAS# 138570-50-0]

Identification

• Name: 10-Hydroxy-2,4a,6a,8a,9,14a-Hexamethyl-11-Oxo-1,3,4,5,6,6a,6b,7,8,13,14,14b-Dodecahydropicene-2-Carboxylic Acid
• Synonyms: 10-Hydroxy-11-Keto-2,4A,6A,8A,9,14A-Hexamethyl-1,3,4,5,6,6A,6B,7,8,13,14,14B-Dodecahydropicene-2-Carboxylic Acid; Tripterygone; 3-Hydroxy-25-Norfriedel-3,1(10)-Dien-2-One-30-Oic Acid
• Molecular Formula: C₂₉H₄₂O₄
• Molecular Weight: 454.65
• CAS Registry Number: 138570-50-0
• SMILES: CC5(CCC4(CCC3(C2CCC1(C(=C(C(C=C1C2CCC3(C4C5)C)=O)O)C)C)C)C)C(O)=O
• InChI: 1S/C29H42O4/c1-17-23(31)21(30)15-20-18-7-10-29(6)22-16-26(3,24(32)33)12-11-25(22,2)13-14-28(29,5)19(18)8-9-27(17,20)4/h15,18-19,22,31H,7-14,16H2,1-6H3,(H,32,33)
• InChIKey: GWXSHQWMMUKHDX-UHFFFAOYSA-N

Properties

• Density: 1.173g/cm³ (Cal.)
• Boiling point: 599.644°C at 760 mmHg (Cal.)
• Flash point: 330.482°C (Cal.)