(4R,12R,20R,28R)-4,12,20,28-Tetrahydroxy-2,10,18,26-tritriacontanetetrone
[CAS# 88212-12-8]

Identification

• Name: (4R,12R,20R,28R)-4,12,20,28-Tetrahydroxy-2,10,18,26-tritriacontanetetrone
• Synonyms: PM-Toxin A; C08553
• Molecular Formula: C₃₃H₆₀O₈
• Molecular Weight: 584.82
• CAS Registry Number: 88212-12-8
• SMILES: O=C(C)C[C@H](O)CCCCCC(=O)C[C@H](O)CCCCCC(=O)C[C@H](O)CCCCCC(=O)C[C@H](O)CCCCC
• InChI: 1S/C33H60O8/c1-3-4-8-15-28(36)23-29(37)18-11-6-12-19-32(40)25-33(41)21-14-7-13-20-31(39)24-30(38)17-10-5-9-16-27(35)22-26(2)34/h27-28,31-32,35-36,39-40H,3-25H2,1-2H3/t27-,28-,31-,32-/m1/s1
• InChIKey: RFJUKGGHUDCGDN-QWWQXMGCSA-N

Properties

• Density: 1.057g/cm³ (Cal.)
• Boiling point: 757.394°C at 760 mmHg (Cal.)
• Flash point: 425.78°C (Cal.)