Aetioporphyrin III; Ni complex
AlkaPlorer ID: AK283496
Synonym: None
IUPAC Name: 2,7,12,18-tetraethyl-3,8,13,17-tetramethylporphyrin-22,23-diide
Structure
SMILES: CCC1=C(C)C2=NC1=CC1=C(C)C(CC)=C(C=C3N=C(C=C4[N-]C(=C2)C(CC)=C4C)C(C)=C3CC)[N-]1
InChI: InChI=1S/C32H36N4/c1-9-21-17(5)25-13-26-18(6)23(11-3)31(34-26)16-32-24(12-4)20(8)28(36-32)15-30-22(10-2)19(7)27(35-30)14-29(21)33-25/h13-16H,9-12H2,1-8H3/q-2
InChIKey: ZQYKIMXCXDMCFO-UHFFFAOYSA-N
Reference
PubChem CID: 7566620
Source
Properties Information
Molecule Weight: 476.6680000000003
TPSA？: 53.98
MolLogP？: 7.996040000000009
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 5
Activities Information
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