CHEBI:197143 - 17-F4-NeuroP

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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 17-F4-NeuroP
ChEBI ID CHEBI:197143
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H34O5
Net Charge 0
Average Mass 378.509
Monoisotopic Mass 378.24062
InChI InChI=1S/C22H34O5/c1-2-3-8-11-17(23)14-15-19-18(20(24)16-21(19)25)12-9-6-4-5-7-10-13-22(26)27/h3,5-9,14-15,17-21,23-25H,2,4,10-13,16H2,1H3,(H,26,27)/b7-5-,8-3-,9-6-,15-14+
InChIKey DSZPTRJZWQQVFK-HOGCIABESA-N
SMILES OC1C(C(C(O)C1)/C=C/C(O)C/C=C\CC)C/C=C\C/C=C\CCC(O)=O
Metabolite of Species Details
Cannabis sativa (NCBI:txid3483) Found in inflorescence (BTO:0000628). of strain Cannabis sativa var. DMG265 See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 17-F4-NeuroP (CHEBI:197143) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
(4Z,7Z)-9-[3,5-dihydroxy-2-[(1E,5Z)-3-hydroxyocta-1,5-dienyl]cyclopentyl]nona-4,7-dienoic acid
Manual Xrefs Databases
113386098 ChemSpider
LMFA04010002 LIPID MAPS
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