EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:167480 - uroporphyrin I(8−)

ChEBI IDCHEBI:167480
ChEBI Nameuroporphyrin I(8−)
Stars
ASCII Nameuroporphyrin I(8-)
DefinitionA cyclic tetrapyrrole anion obtained by deprotonation of the carboxy groups of uroporphyrin I; major species at pH 7.3.
Submitternhn
DownloadsMolfile
FormulaC40H30N4O16
Net Charge-8
Average Mass822.692
Monoisotopic Mass822.17007
SMILESO=C([O-])CCC1=C(CC(=O)[O-])c2cc3nc(cc4nc(cc5nc(cc1n2)c(CC(=O)[O-])c5CCC(=O)[O-])C(CC(=O)[O-])=C4CCC(=O)[O-])c(CC(=O)[O-])c3CCC(=O)[O-]
InChIInChI=1S/C40H38N4O16/c45-33(46)5-1-17-21(9-37(53)54)29-14-26-19(3-7-35(49)50)23(11-39(57)58)31(43-26)16-28-20(4-8-36(51)52)24(12-40(59)60)32(44-28)15-27-18(2-6-34(47)48)22(10-38(55)56)30(42-27)13-25(17)41-29/h13-16,41,44H,1-12H2,(H,45,46)(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)/p-8/b25-13-,26-14-,27-15-,28-16-,29-14-,30-13-,31-16-,32-15-
InChIKeyDAFUFNRZWDWXJP-JRHDEHKPSA-F
ChEBI Ontology
Outgoing Relation(s)
uroporphyrin I(8−) (CHEBI:167480) is a cyclic tetrapyrrole anion (CHEBI:58941)
uroporphyrin I(8−) (CHEBI:167480) is conjugate base of uroporphyrin I (CHEBI:27484)
Incoming Relation(s)
uroporphyrin I (CHEBI:27484) is conjugate acid of uroporphyrin I(8−) (CHEBI:167480)
UniProt Name  Source
uroporphyrin IUniProt
Citations