3alpha,7beta,18-Trihydroxy-ent-kaur-16-ene
[CAS# 37720-78-8]

Identification

• Name: 3alpha,7beta,18-Trihydroxy-ent-kaur-16-ene
• Synonyms: Inchi=1/C20h32o3/C1-12-9-20-10-13(12)4-5-14(20)18(2)7-6-16(22)19(3,11-21)15(18)8-17(20)23/H13-17,21-23H,1,4-11H2,2-3H3/T13-,14+,15?,16-,17+,18+,19-,20?/M1/S; (3Alpha,5Xi,7Beta,8Alpha,9Beta,10Alpha,13Alpha)-Kaur-16-Ene-3,7,19-Triol; 2-Hexadecen-1-Ol, 3,7,11,15-Tetramethyl-, Acetate, (2E)-
• Molecular Formula: C₂₀H₃₂O₃
• Molecular Weight: 320.47
• CAS Registry Number: 37720-78-8
• SMILES: [C@]234[C@H]([C@@]1(CC[C@H]([C@@]([C@H]1C[C@@H]2O)(CO)C)O)C)CC[C@H](C3)C(C4)=C
• InChI: 1S/C20H32O3/c1-12-9-20-10-13(12)4-5-14(20)18(2)7-6-16(22)19(3,11-21)15(18)8-17(20)23/h13-17,21-23H,1,4-11H2,2-3H3/t13-,14+,15+,16-,17+,18+,19-,20+/m1/s1
• InChIKey: ZHAIQJLGKAVXSD-SSADKFRXSA-N

Properties

• Density: 1.17g/cm³ (Cal.)
• Boiling point: 470.025°C at 760 mmHg (Cal.)
• Flash point: 212.631°C (Cal.)