CHEBI:142775 - FADH2-C4α-hydroperoxide(2−)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name FADH2-C4α-hydroperoxide(2−)
ChEBI ID CHEBI:142775
ChEBI ASCII Name FADH2-C4alpha-hydroperoxide(2-)
Definition A FADH2 analogue obtained by hydroperoxidation at the C4α-position; major species at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C27H33N9O17P2
Net Charge -2
Average Mass 817.550
Monoisotopic Mass 817.14806
InChI InChI=1S/C27H35N9O17P2/c1-10-3-12-13(4-11(10)2)35(24-27(34-12,52-44)25(42)33-26(43)32-24)5-14(37)18(39)15(38)6-49-54(45,46)53-55(47,48)50-7-16-19(40)20(41)23(51-16)36-9-31-17-21(28)29-8-30-22(17)36/h3-4,8-9,14-16,18-20,23,34,37-41,44H,5-7H2,1-2H3,(H,45,46)(H,47,48)(H2,28,29,30)(H,33,42,43)/p-2/t14-,15+,16+,18-,19+,20+,23+,27?/m0/s1
InChIKey GPSQSNUPRVYZDD-XDHWKVHASA-L
SMILES P(=O)([O-])(OC[C@H]([C@@H](O)[C@H](CN1C2=NC(=O)NC(C2(NC3=C1C=C(C)C(=C3)C)OO)=O)O)O)OP(=O)(OC[C@H]4O[C@@H](N5C6=C(C(=NC=N6)N)N=C5)[C@@H]([C@@H]4O)O)[O-]
Roles Classification
Biological Role(s): cofactor
An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group).
(via flavin adenine dinucleotide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing FADH2-C4α-hydroperoxide(2−) (CHEBI:142775) has functional parent FADH2(2−) (CHEBI:58307)
FADH2-C4α-hydroperoxide(2−) (CHEBI:142775) is a flavin adenine dinucleotide (CHEBI:24040)
FADH2-C4α-hydroperoxide(2−) (CHEBI:142775) is a hydroperoxide (CHEBI:35923)
Synonym Source
FADH2-C4α-hydroperoxide UniProt
Citation Waiting for Citations Type Source
29398560 PubMed citation SUBMITTER