(3beta)-Solanid-5-En-3-Ol Hydrochloride
[CAS# 5189-62-8]

Identification

• Name: (3beta)-Solanid-5-En-3-Ol Hydrochloride
• Synonyms: Solanid-5-En-3-Ol, Hydrochloride, (3Beta)-
• Molecular Formula: C₂₇H₄₄ClNO
• Molecular Weight: 434.10
• CAS Registry Number: 5189-62-8
• EINECS: 225-973-0
• SMILES: [C@]34([C@@H]1[C@@H](N2[C@@H]([C@H]1C)CC[C@@H](C2)C)C[C@H]3[C@H]5[C@H](CC4)[C@@]6(C(=CC5)C[C@@H](O)CC6)C)C.[H+].[Cl-]
• InChI: 1S/C27H43NO.ClH/c1-16-5-8-23-17(2)25-24(28(23)15-16)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4;/h6,16-17,19-25,29H,5,7-15H2,1-4H3;1H/t16-,17+,19-,20+,21-,22-,23+,24-,25-,26-,27-;/m0./s1
• InChIKey: GFSDTBOYJKNJHE-QQGZXNMISA-N

Properties

• Boiling point: 503.1°C at 760 mmHg (Cal.)
• Flash point: 223.5°C (Cal.)