5,6,7-Trihydroxy-18-Methyloxacyclooctadecan-2-One
[CAS# 52461-08-2]

Identification

• Name: 5,6,7-Trihydroxy-18-Methyloxacyclooctadecan-2-One
• Synonyms: 5,6,7-Trihydroxy-18-methyloxacyclooctadecan-2-one #; Dihydroaspicilin
• Molecular Formula: C₁₈H₃₄O₅
• Molecular Weight: 330.46
• CAS Registry Number: 52461-08-2
• SMILES: O=C1OC(CCCCCCCCCCC(O)C(O)C(O)CC1)C
• InChI: 1S/C18H34O5/c1-14-10-8-6-4-2-3-5-7-9-11-15(19)18(22)16(20)12-13-17(21)23-14/h14-16,18-20,22H,2-13H2,1H3
• InChIKey: DMJJBRBTLBZJOL-UHFFFAOYSA-N

Properties

• Density: 1.04g/cm³ (Cal.)
• Boiling point: 502.141°C at 760 mmHg (Cal.)
• Flash point: 172.422°C (Cal.)