Dihydroergocryptine
[CAS# 25447-66-9]

Identification

• Name: Dihydroergocryptine
• Synonyms: Dihydroergocryptine; Dihydroergokryptine
• Molecular Formula: C₃₂H₄₃N₅O₅
• Molecular Weight: 577.72
• CAS Registry Number: 25447-66-9
• EINECS: 246-993-6
• SMILES: [C@]13(N([C@H](C(=O)N2[C@H]1CCC2)CC(C)C)C(=O)[C@@](O3)(NC([C@@H]7C[C@@H]6C5=C4C(=C[NH]C4=CC=C5)C[C@H]6N(C7)C)=O)C(C)C)O
• InChI: 1S/C32H43N5O5/c1-17(2)12-25-29(39)36-11-7-10-26(36)32(41)37(25)30(40)31(42-32,18(3)4)34-28(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-24(22)35(5)16-20/h6,8-9,15,17-18,20,22,24-26,33,41H,7,10-14,16H2,1-5H3,(H,34,38)/t20-,22-,24-,25+,26+,31-,32+/m1/s1
• InChIKey: PBUNVLRHZGSROC-VTIMJTGVSA-N

Properties

• Density: 1.362g/cm³ (Cal.)
• Boiling point: 848.658°C at 760 mmHg (Cal.)
• Flash point: 467.052°C (Cal.)