16alpha-Methylyohimban-17alpha-Ol
[CAS# 549-79-1]

Identification

• Name: 16alpha-Methylyohimban-17alpha-Ol
• Synonyms: 16-Alpha-Methylyohimbol; Yohimban-17-Alpha-Ol, 16-Alpha-Methyl-
• Molecular Formula: C₂₀H₂₆N₂O
• Molecular Weight: 310.44
• CAS Registry Number: 549-79-1
• SMILES: [C@H]34C2=C(C1=CC=CC=C1[NH]2)CCN3C[C@H]5[C@H](C4)[C@H]([C@H](CC5)O)C
• InChI: 1S/C20H26N2O/c1-12-16-10-18-20-15(14-4-2-3-5-17(14)21-20)8-9-22(18)11-13(16)6-7-19(12)23/h2-5,12-13,16,18-19,21,23H,6-11H2,1H3/t12-,13+,16-,18+,19+/m1/s1
• InChIKey: UDCOGXBNLMAMMD-KOYAIAQHSA-N

Properties

• Density: 1.242g/cm³ (Cal.)
• Boiling point: 502.07°C at 760 mmHg (Cal.)
• Flash point: 257.443°C (Cal.)