Ochraceolide C
[CAS# 138913-63-0]

Identification

• Name: Ochraceolide C
• Synonyms: Lup-20(30)-En-29-Oic Acid, 29-Hydroxy-3,6-Dioxo-, Gamma-Lactone, (21Alpha)-; Ochraceolide C
• Molecular Formula: C₃₀H₄₂O₄
• Molecular Weight: 466.66
• CAS Registry Number: 138913-63-0
• SMILES: [C@@]34([C@]1([C@@H]([C@@]2([C@@H](C(=O)C1)C(C(=O)CC2)(C)C)C)CC[C@@H]3[C@@H]5[C@@](CC4)(CC6OC(=O)C([C@@H]56)=C)C)C)C
• InChI: 1S/C30H42O4/c1-16-22-19(34-25(16)33)15-27(4)12-13-29(6)17(23(22)27)8-9-20-28(5)11-10-21(32)26(2,3)24(28)18(31)14-30(20,29)7/h17,19-20,22-24H,1,8-15H2,2-7H3/t17-,19?,20-,22-,23+,24+,27+,28-,29-,30-/m1/s1
• InChIKey: BZYBPXXQSABSLD-RCUGQCPPSA-N

Properties

• Density: 1.155g/cm³ (Cal.)
• Boiling point: 586.575°C at 760 mmHg (Cal.)
• Flash point: 247.954°C (Cal.)