19-hydroxyprostaglandin H1(1-) (CHEBI:90801)

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CHEBI:90801 - 19-hydroxyprostaglandin H₁(1−)

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ChEBI ID	CHEBI:90801
ChEBI Name	19-hydroxyprostaglandin H₁(1−)
Stars
ASCII Name	19-hydroxyprostaglandin H1(1-)
Definition	A prostaglandin carboxylic acid anion that is the conjugate base of 19-hydroxyprostaglandin H₁, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified	12 August 2016
Submitter	AnneNiknejad
Downloads	Molfile

Formula	C20H33O6
Net Charge	-1
Average Mass	369.478
Monoisotopic Mass	369.22826
SMILES	CC(O)CCC[C@H](O)/C=C/[C@@H]1[C@@H](CCCCCCC(=O)[O-])[C@@H]2C[C@H]1OO2
InChI	InChI=1S/C20H34O6/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/h11-12,14-19,21-22H,2-10,13H2,1H3,(H,23,24)/p-1/b12-11+/t14?,15-,16+,17+,18-,19+/m0/s1
InChIKey	WIWFIKCSWKFLRM-UZTSRZBGSA-M

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	-	PubMed (10791960)

Roles Classification

Biological Role:

human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans.

ChEBI Ontology

Outgoing Relation(s)
	19-hydroxyprostaglandin H₁(1−) (CHEBI:90801) has role human xenobiotic metabolite (CHEBI:76967)
	19-hydroxyprostaglandin H₁(1−) (CHEBI:90801) is a oxylipin anion (CHEBI:62933)
	19-hydroxyprostaglandin H₁(1−) (CHEBI:90801) is a prostaglandin carboxylic acid anion (CHEBI:59326)
	19-hydroxyprostaglandin H₁(1−) (CHEBI:90801) is conjugate base of 19-hydroxyprostaglandin H₁ (CHEBI:91135)
Incoming Relation(s)
Incoming Relation(s)	19-hydroxyprostaglandin H₁ (CHEBI:91135) is conjugate acid of 19-hydroxyprostaglandin H₁(1−) (CHEBI:90801)

IUPAC Name
7-{(1R,4S,5R,6R)-6-[(1E,3S)-3,7-dihydroxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]heptan-5-yl}heptanoate

UniProt Name	Source
19-hydroxyprostaglandin H₁	UniProt

Citations