(17Z,23Z)-4,6,8,10,12,14,15,16,27-Nonahydroxy-3-(1-hydroxyhexyl)-17,28-dimethyloxacyclooctacosa-17,19,21,23,25-pentaen-2-one
[CAS# 78361-81-6]

Identification

• Name: (17Z,23Z)-4,6,8,10,12,14,15,16,27-Nonahydroxy-3-(1-hydroxyhexyl)-17,28-dimethyloxacyclooctacosa-17,19,21,23,25-pentaen-2-one
• Synonyms: Elizabethin
• Molecular Formula: C₃₅H₅₈O₁₂
• Molecular Weight: 670.83
• CAS Registry Number: 78361-81-6
• SMILES: O=C1OC(C(O)C=C/C=C\C=CC=C/C=C(/C)C(O)C(O)C(O)CC(O)CC(O)CC(O)CC(O)CC(O)C1C(O)CCCCC)C
• InChI: 1S/C35H58O12/c1-4-5-11-16-29(41)32-30(42)20-26(38)18-24(36)17-25(37)19-27(39)21-31(43)34(45)33(44)22(2)14-12-9-7-6-8-10-13-15-28(40)23(3)47-35(32)46/h6-10,12-15,23-34,36-45H,4-5,11,16-21H2,1-3H3/b7-6?,10-8-,12-9?,15-13?,22-14-
• InChIKey: AGJUUQSLGVCRQA-UPBPMIRPSA-N

Properties

• Density: 1.196g/cm³ (Cal.)
• Boiling point: 913.965°C at 760 mmHg (Cal.)
• Flash point: 278.417°C (Cal.)