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CHEBI:136888 - 15,173-seco-F430-173-acid(5−)

ChEBI IDCHEBI:136888
ChEBI Name15,173-seco-F430-173-acid(5−)
Stars
ASCII Name15,17(3)-seco-F430-17(3)-acid(5-)
DefinitionA cyclic tetrapyrrole anion obtained by deprotonation of the carboxy groups of 15,173-seco-F430-173-acid; major species at pH 7.3.
Last Modified14 March 2025
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC42H47N6NiO14
Net Charge-5
Average Mass918.559
Monoisotopic Mass917.25311
SMILESC[C@@]12CC(=O)N[C@@]13C[C@H]1[C@@H](CCC(=O)[O-])[C@](C)(CC(N)=O)C4=[N+]1[Ni-2]15[N]6C(=CC7=[N+]1[C@H](C4)[C@@H](CC(=O)[O-])[C@@H]7CCC(=O)[O-])[C@@H](CCC(=O)[O-])[C@H](CC(=O)[O-])C6=CC(=[N+]35)[C@H]2CCC(=O)[O-]
InChIInChI=1S/C42H54N6O14.Ni/c1-40(17-32(43)49)23(5-9-36(55)56)30-16-42-41(2,18-33(50)48-42)24(6-10-37(57)58)29(47-42)14-27-21(11-38(59)60)19(3-7-34(51)52)25(44-27)13-26-20(4-8-35(53)54)22(12-39(61)62)28(45-26)15-31(40)46-30;/h13-14,19-24,28,30H,3-12,15-18H2,1-2H3,(H10,43,44,45,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62);/q;+2/p-7/t19-,20-,21-,22-,23+,24+,28+,30-,40-,41-,42-;/m0./s1
InChIKeyHHAOAZMDQIXGKF-MYQROCLPSA-G
ChEBI Ontology
Outgoing Relation(s)
15,173-seco-F430-173-acid(5−) (CHEBI:136888) is a cyclic tetrapyrrole anion (CHEBI:58941)
15,173-seco-F430-173-acid(5−) (CHEBI:136888) is a hexacarboxylic acid anion (CHEBI:59360)
15,173-seco-F430-173-acid(5−) (CHEBI:136888) is conjugate base of 15,173-seco-F430-173-acid (CHEBI:137699)
Incoming Relation(s)
15,173-seco-F430-173-acid (CHEBI:137699) is conjugate acid of 15,173-seco-F430-173-acid(5−) (CHEBI:136888)
UniProt Name  Source
15,173-seco-F430-173-acidUniProt
Manual XrefsDatabases
CPD-7592MetaCyc
Citations