CHEBI:174985 - 7-hydroxy-D4-neuroprostane

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 7-hydroxy-D4-neuroprostane
ChEBI ID CHEBI:174985
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/c1-2-3-4-5-6-9-12-18-19(21(25)16-20(18)24)15-14-17(23)11-8-7-10-13-22(26)27/h3-4,6-9,14-15,17-19,21,23,25H,2,5,10-13,16H2,1H3,(H,26,27)/b4-3-,8-7-,9-6-,15-14+
InChIKey MBWYKQQOOVDDJT-UGCWMZKCSA-N
SMILES OC1C(C(C(=O)C1)C/C=C\C/C=C\CC)/C=C/C(O)C/C=C\CCC(O)=O
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 7-hydroxy-D4-neuroprostane (CHEBI:174985) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
(4Z,8E)-7-hydroxy-9-[5-hydroxy-2-[(2Z,5Z)-octa-2,5-dienyl]-3-oxocyclopentyl]nona-4,8-dienoic acid
Manual Xrefs Databases
35032550 ChemSpider
5Z13E-15S-1115-DIHYDROXY-9-OXOPROS MetaCyc
C00584 KEGG COMPOUND
HMDB0012855 HMDB
View more database links