Methyl 11,17alpha,18alpha-Trimethoxy-3beta,20alpha-Yohimban-16beta-Carboxylate Monohydrochloride
[CAS# 1178-29-6]

Identification

• Name: Methyl 11,17alpha,18alpha-Trimethoxy-3beta,20alpha-Yohimban-16beta-Carboxylate Monohydrochloride
• Synonyms: 3-Beta,15-Alpha,20-Alpha-Yohimban-16-Beta-Carboxylic Acid, 11,17-Alpha,18-Alpha-Trimethoxy-, Methyl Ester, Hydrochloride; 3Beta,20Alpha-Yohimban-16Beta-Carboxylic Acid, 11,17Alpha,18Alpha-Trimethoxy-, Methyl Ester, Monohydrochloride (8Ci); Avicalm
• Molecular Formula: C₂₄H₃₃ClN₂O₅
• Molecular Weight: 464.99
• CAS Registry Number: 1178-29-6
• SMILES: [C@@H]15[C@@H](CN2[C@H](C1)C3=C(CC2)C4=C([NH]3)C=C(OC)C=C4)C[C@H](OC)[C@H](OC)[C@H]5C(OC)=O.[H+].[Cl-]
• InChI: 1S/C24H32N2O5.ClH/c1-28-14-5-6-15-16-7-8-26-12-13-9-20(29-2)23(30-3)21(24(27)31-4)17(13)11-19(26)22(16)25-18(15)10-14;/h5-6,10,13,17,19-21,23,25H,7-9,11-12H2,1-4H3;1H/t13-,17+,19-,20+,21+,23+;/m1./s1
• InChIKey: RVUCXCLULXWKIQ-PKNINNMNSA-N

Properties

• Boiling point: 566.5°C at 760 mmHg (Cal.)
• Flash point: 296.4°C (Cal.)