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Concept information

Preferred term

pentacarboxyl porphyrinogen iii  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C37H40N4O10

inchi

  • InChI=1S/C37H40N4O10/c1-17-20(4-8-33(42)43)28-14-27-19(3)22(6-10-35(46)47)30(40-27)16-32-24(12-37(50)51)23(7-11-36(48)49)31(41-32)15-29-21(5-9-34(44)45)18(2)26(39-29)13-25(17)38-28/h14-16,26,38,41H,4-13H2,1-3H3,(H,42,43)(H,44,45)(H,46,47)(H,48,49)(H,50,51)/b27-14-,31-15-,32-16-

inchikey

  • QDDLLFZOMVJQEQ-XJTMSCLRSA-N

mass

  • 700.745

monoisotopicmass

  • 700.27444

smiles

  • OC(=O)CCC1=C(C2N=C1C=C3NC(C(=C3CCC(O)=O)CC(O)=O)=CC4=NC(=CC=5NC(C2)=C(C5CCC(O)=O)C)C(=C4CCC(O)=O)C)C

subset

  • 2_STAR

synonym EXACT

  • 3-[(10Z,15Z,19Z)-8,13,18-tris(2-carboxyethyl)-17-(carboxymethyl)-3,7,12-trimethyl-4,5,22,24-tetrahydroporphyrin-2-yl]propanoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:177797

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