Cytochrome c1
[CAS# 9035-42-1]

Identification

• Name: Cytochrome c1
• Synonyms: CYTOCHROME C1; C02021
• Molecular Formula: C₄₇H₅₈FeN₄O₄S₂
• Molecular Weight: 862.96
• CAS Registry Number: 9035-42-1
• SMILES: [Fe+2].O=C(CC)C(C)CSC(c1c3[n-]c(c1C)cc/5nc(cc2[n-]c(cc2CCC(=O)C)cc/4nc(c3)\C(=C\4C(SCC(C(=O)CC)C)C)C)\C(=C\5C)CCC(=O)C)C
• InChI: 1S/C47H58N4O4S2.Fe/c1-12-44(54)25(3)23-56-32(10)46-31(9)39-21-43-47(33(11)57-24-26(4)45(55)13-2)30(8)38(51-43)20-37-29(7)36(17-15-28(6)53)41(49-37)22-40-34(16-14-27(5)52)18-35(48-40)19-42(46)50-39;/h18-22,25-26,32-33H,12-17,23-24H2,1-11H3;/q-2;+2/b35-19-,37-20-,38-20-,39-21-,40-22-,41-22-,42-19-,43-21-
• InChIKey: DSSJNBBTFMOAOZ-FSXLTZBASA-N

Properties

• Boiling point: 1108.1°C at 760 mmHg (Cal.)
• Flash point: 623.9°C (Cal.)