Cyanoaqua-cobyrinic acid heptakis(2-phenylethyl ester)

化合物标识与属性

CAS

130549-56-3

PubChem CID

167996579

SMILES

C/C/1=C/2\C(C(C(=N2)/C=C\3/C(C(/C(=C(/C4=NC(C5C(C(C1=N5)(C)CCC(=O)OCCC6=CC=CC=C6)CC(=O)OCCC7=CC=CC=C7)(C(C4CCC(=O)OCCC8=CC=CC=C8)(C)CC(=O)OCCC9=CC=CC=C9)C)\C)/N3)(C)CC(=O)OCCC1=CC=CC=C1)CCC(=O)OCCC1=CC=CC=C1)(C)C)CCC(=O)OCCC1=CC=CC=C1.[C-]#N.O.[O-]Cl(=O)(=O)=O.[Co+2]

Canonical SMILES

C/C1=C2/N=C(/C=C3\N/C(=C(/C)C4=NC(C)(C5N=C1C(C)(CCC(=O)OCCc1ccccc1)C5CC(=O)OCCc1ccccc1)C(C)(CC(=O)OCCc1ccccc1)C4CCC(=O)OCCc1ccccc1)C(C)(CC(=O)OCCc1ccccc1)C3CCC(=O)OCCc1ccccc1)C(C)(C)C2CCC(=O)OCCc1ccccc1.O.[C-]#N.[Co+2].[O-][Cl+3]([O-])([O-])[O-]