(2R,3S)-23-oxidanyl-5,10,15,20-tetraphenyl-3,22-dihydro-2H-porphyrin-2,3-diol

Systemtic Name: (2R,3S)-23-oxidanyl-5,10,15,20-tetraphenyl-3,22-dihydro-2H-porphyrin-2,3-diol Openeye Name: (2R,3S)-23-hydroxy-5,10,15,20-tetraphenyl-3,22-dihydro-2H-porphyrin-2,3-diol CAS Name: (2R,3S)-23-hydroxy-5,10,15,20-tetraphenyl-3,22-dihydro-2H-porphyrin-2,3-diol IUPAC Name: (2R,3S)-23-hydroxy-5,10,15,20-tetraphenyl-3,22-dihydro-2H-porphyrin-2,3-diol Traditional Name: (2R,3S)-23-hydroxy-5,10,15,20-tetraphenyl-3,22-dihydro-2H-porphine-2,3-diol Formula: C44H32N4O3 MolecularWeight: 664.74988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6O)C7=CC=CC=C7)C=C5)C8=CC=CC=C8)C(C4O)O)C9=CC=CC=C9)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2N6O)C7=CC=CC=C7)C=C5)C8=CC=CC=C8)[C@H]([C@H]4O)O)C9=CC=CC=C9)N3

InChI

InChI=1S/C44H32N4O3/c49-43-41-39(29-17-9-3-10-18-29)33-23-21-31(45-33)37(27-13-5-1-6-14-27)35-25-26-36(48(35)51)38(28-15-7-2-8-16-28)32-22-24-34(46-32)40(42(47-41)44(43)50)30-19-11-4-12-20-30/h1-26,43-45,49-51H/t43-,44+/m0/s1