Chem
J-GLOBAL ID：200907022676787198   Nikkaji number：J14.910A

Coproporphyrin III

コプロポルフィリンIII
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C36H38N4O8
Molecular formula furigana： C36-H38-N4-O8
Molecular weight： 654.720
InChI： InChI=1S/C36H38N4O8/c1-17-21(5-9-33(41)42)29-14-27-19(3)22(6-10-34(43)44)30(39-27)15-28-20(4)24(8-12-36(47)48)32(40-28)16-31-23(7-11-35(45)46)18(2)26(38-31)13-25(17)37-29/h13-16,37,40H,5-12H2,1-4H3,(H,41,42)(H,43,44)(H,45,46)(H,47,48)/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-
InChI key： JWFCYWSMNRLXLX-UJJXFSCMSA-N
SMILES： CC1=C(CCC(=O)O)C2=N/C/1=C\c1[nH]c(/C=C/3\N=C(/C=c/4\[nH]/c(=C\2)/c(c4C)CCC(=O)O)C(=C3C)CCC(=O)O)c(c1C)CCC(=O)O
Systematic name  (1)：
  • 2,7,12,18-テトラメチル-21H,23H-ポルフィリン-3,8,13,17-テトラプロピオン酸
Other name (3)：
  • コプロポルフィリンIII
  • Coproporphyrin III
  • 2,7,12,18-Tetramethyl-21H,23H-porphyrin-3,8,13,17-tetrapropionic acid
CAS registry number： 14643-66-4
KEGG COMPOUND： C05770
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