CHEBI:174982 - 20-hydroxy-E4-neuroprostane

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ChEBI Name 20-hydroxy-E4-neuroprostane
ChEBI ID CHEBI:174982
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H32O5
Net Charge 0
Average Mass 376.493
Monoisotopic Mass 376.22497
InChI InChI=1S/C22H32O5/c1-2-17(23)14-15-19-18(20(24)16-21(19)25)12-10-8-6-4-3-5-7-9-11-13-22(26)27/h3-4,7-10,14-15,17-19,21,23,25H,2,5-6,11-13,16H2,1H3,(H,26,27)/b4-3-,9-7-,10-8-,15-14+
InChIKey BIHPRUQXOKWQGU-KBUBQVDUSA-N
SMILES OC1C(C(C(=O)C1)C/C=C\C/C=C\C/C=C\CCC(O)=O)/C=C/C(O)CC
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 20-hydroxy-E4-neuroprostane (CHEBI:174982) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name
(4Z,7Z,10Z)-12-[3-hydroxy-2-[(E)-3-hydroxypent-1-enyl]-5-oxocyclopentyl]dodeca-4,7,10-trienoic acid
Manual Xrefs Databases
35032545 ChemSpider
5Z13E-15S-1115-DIHYDROXY-9-OXOPROS MetaCyc
C00584 KEGG COMPOUND
HMDB0012638 HMDB
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