4-oxidanylpyrrolidine-2-carboxylic acid; 7,8,21,23-tetrahydroporphyrin-2-carbaldehyde

Systemtic Name: 4-oxidanylpyrrolidine-2-carboxylic acid; 7,8,21,23-tetrahydroporphyrin-2-carbaldehyde Openeye Name: 4-hydroxypyrrolidine-2-carboxylic acid; 7,8,21,23-tetrahydroporphyrin-2-carbaldehyde CAS Name: 4-hydroxy-2-pyrrolidinecarboxylic acid; 7,8,21,23-tetrahydroporphyrin-2-carboxaldehyde IUPAC Name: 4-hydroxypyrrolidine-2-carboxylic acid; 7,8,21,23-tetrahydroporphyrin-2-carbaldehyde Traditional Name: 4-hydroxyproline; 7,8,21,23-tetrahydroporphine-2-carbaldehyde Formula: C26H25N5O4 MolecularWeight: 471.5078

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC1=CC3=CC(=C(N3)C=C4C=CC(=N4)C=C5C=CC(=C2)N5)C=O.C1C(CNC1C(=O)O)O

Isomeric SMILES

C1CC2=NC1=CC3=CC(=C(N3)C=C4C=CC(=N4)C=C5C=CC(=C2)N5)C=O.C1C(CNC1C(=O)O)O

InChI

InChI=1S/C21H16N4O.C5H9NO3/c26-12-13-7-20-10-18-4-3-16(23-18)8-14-1-2-15(22-14)9-17-5-6-19(24-17)11-21(13)25-20;7-3-1-4(5(8)9)6-2-3/h1-2,5-12,22,25H,3-4H2;3-4,6-7H,1-2H2,(H,8,9)