3beta-Hydroxy-20-oxo-30-norlupan-28-oic acid
[CAS# 6060-06-6]

Identification

• Name: 3beta-Hydroxy-20-oxo-30-norlupan-28-oic acid
• Synonyms: 3Beta-Hydroxy-20-Oxo-30-Norlupan-28-Oic Acid; Platanic Acid; 3-Hydroxy-20-Oxonorlupan-28-Oic Acid, (3.Beta.)
• Molecular Formula: C₂₉H₄₆O₄
• Molecular Weight: 458.68
• CAS Registry Number: 6060-06-6
• SMILES: [C@@]13([C@@H]([C@@H]2[C@@](CC1)(CC[C@H]2C(=O)C)C(=O)O)CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@H](O)C5(C)C)C)C)C
• InChI: 1S/C29H46O4/c1-17(30)18-9-14-29(24(32)33)16-15-27(5)19(23(18)29)7-8-21-26(4)12-11-22(31)25(2,3)20(26)10-13-28(21,27)6/h18-23,31H,7-16H2,1-6H3,(H,32,33)/t18-,19+,20-,21+,22-,23+,26-,27+,28+,29-/m0/s1
• InChIKey: RVMPLOSJMIQORE-FUAAEJBOSA-N

Properties

• Density: 1.107g/cm³ (Cal.)
• Boiling point: 568.061°C at 760 mmHg (Cal.)
• Flash point: 311.402°C (Cal.)