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18-(2-carboxyethyl)-20-(carboxymethyl)-12-ethenyl-7-ethyl-3,13,17-trimethyl-17,18,22,23-tetrahydroporphyrin-2-carboxylic acid

18-(2-carboxyethyl)-20-(carboxymethyl)-12-ethenyl-7-ethyl-3,13,17-trimethyl-17,18,22,23-tetrahydroporphyrin-2-carboxylic acid

Systemtic Name:18-(2-carboxyethyl)-20-(carboxymethyl)-12-ethenyl-7-ethyl-3,13,17-trimethyl-17,18,22,23-tetrahydroporphyrin-2-carboxylic acid
Openeye Name:18-(2-carboxyethyl)-20-(carboxymethyl)-7-ethyl-3,13,17-trimethyl-12-vinyl-17,18,22,23-tetrahydroporphyrin-2-carboxylic acid
CAS Name:18-(2-carboxyethyl)-20-(carboxymethyl)-12-ethenyl-7-ethyl-3,13,17-trimethyl-17,18,22,23-tetrahydroporphyrin-2-carboxylic acid
IUPAC Name:18-(2-carboxyethyl)-20-(carboxymethyl)-12-ethenyl-7-ethyl-3,13,17-trimethyl-17,18,22,23-tetrahydroporphyrin-2-carboxylic acid
Traditional Name:18-(2-carboxyethyl)-20-(carboxymethyl)-7-ethyl-3,13,17-trimethyl-12-vinyl-17,18,22,23-tetrahydroporphine-2-carboxylic acid
Formula: C33H34N4O6
MolecularWeight: 582.64626
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CC3=C(C(=C(N3)C=C4C(C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)C)C(=O)O)CC(=O)O)CCC(=O)O)C)C)C=C


Isomeric SMILES

CCC1=CC2=CC3=C(C(=C(N3)C=C4C(C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)C)C(=O)O)CC(=O)O)CCC(=O)O)C)C)C=C


InChI

InChI=1S/C33H34N4O6/c1-6-18-10-19-11-27-20(7-2)15(3)23(35-27)13-24-16(4)21(8-9-28(38)39)31(36-24)22(12-29(40)41)32-30(33(42)43)17(5)25(37-32)14-26(18)34-19/h7,10-11,13-14,16,21,34-35H,2,6,8-9,12H2,1,3-5H3,(H,38,39)(H,40,41)(H,42,43)


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