3-Deoxyaphidicolin
[CAS# 85483-00-7]

Identification

• Name: 3-Deoxyaphidicolin
• Synonyms: 8,11A-Methano-11Ah-Cyclohepta(A)Naphthalene-4,9-Dimethanol, Tetradecahydro-9-Hydroxy-4,11B-Dimethyl-, (4R-(4Alpha,4Aalpha,6Abeta,8Beta,9Beta,11Abeta,11Bbeta))-
• Molecular Formula: C₂₀H₃₄O₃
• Molecular Weight: 322.49
• CAS Registry Number: 85483-00-7
• SMILES: [C@H]13C4([C@@]2([C@@H](CC1)[C@@](CCC2)(CO)C)C)CC[C@@]([C@H](C3)C4)(CO)O
• InChI: 1S/C20H34O3/c1-17(12-21)6-3-7-18(2)16(17)5-4-14-10-15-11-19(14,18)8-9-20(15,23)13-22/h14-16,21-23H,3-13H2,1-2H3/t14-,15+,16-,17-,18-,19?,20-/m0/s1
• InChIKey: VHWTVINEPPOCLA-XLABTPETSA-N

Properties

• Density: 1.16g/cm³ (Cal.)
• Boiling point: 467.342°C at 760 mmHg (Cal.)
• Flash point: 210.159°C (Cal.)