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CHEBI:63912 - 19-hydroxyprostaglandin H2

ChEBI IDCHEBI:63912
ChEBI Name19-hydroxyprostaglandin H2
Stars
ASCII Name19-hydroxyprostaglandin H2
DefinitionA prostaglandin H that consists of prostaglandin H2 bearing an additional hydroxy substituent at position 19.
Last Modified9 February 2016
SubmitterSteve
DownloadsMolfile
FormulaC20H32O6
Net Charge0
Average Mass368.470
Monoisotopic Mass368.21989
SMILESCC(O)CCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H]2C[C@H]1OO2
InChIInChI=1S/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18-13-19(17)26-25-18)9-4-2-3-5-10-20(23)24/h2,4,11-12,14-19,21-22H,3,5-10,13H2,1H3,(H,23,24)/b4-2-,12-11+/t14?,15-,16+,17+,18-,19+/m0/s1
InChIKeyMTVPUJQVDLAVML-AHYYGCRPSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (10791960)
Roles Classification
Chemical Roles:
oxidising agent  A substance that removes electrons from another reactant in a redox reaction.
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
19-hydroxyprostaglandin H2 (CHEBI:63912) has functional parent prostaglandin H2 (CHEBI:15554)
19-hydroxyprostaglandin H2 (CHEBI:63912) has role human xenobiotic metabolite (CHEBI:76967)
19-hydroxyprostaglandin H2 (CHEBI:63912) is a bridged compound (CHEBI:35990)
19-hydroxyprostaglandin H2 (CHEBI:63912) is a olefinic compound (CHEBI:78840)
19-hydroxyprostaglandin H2 (CHEBI:63912) is a organic peroxide (CHEBI:25702)
19-hydroxyprostaglandin H2 (CHEBI:63912) is a oxylipin (CHEBI:61121)
19-hydroxyprostaglandin H2 (CHEBI:63912) is a prostaglandins H (CHEBI:26344)
19-hydroxyprostaglandin H2 (CHEBI:63912) is a secondary alcohol (CHEBI:35681)
19-hydroxyprostaglandin H2 (CHEBI:63912) is conjugate acid of 19-hydroxyprostaglandin H2(1−) (CHEBI:90797)
Incoming Relation(s)
19-hydroxyprostaglandin H2(1−) (CHEBI:90797) is conjugate base of 19-hydroxyprostaglandin H2 (CHEBI:63912)
IUPAC Name 
(5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S)-3,7-dihydroxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]hept-5-yl}hept-5-enoic acid
Synonyms  Source
(5Z,13E,15S)-9α,11α-epidioxy-15,19-dihydroxyprosta-5,13-dienoic acidChEBI
(5Z,9α,11α,13E,15S)-9,11-epidioxy-15,19-dihydroxyprosta-5,13-dien-1-oic acidChEBI
Citations