CHEBI:189255 - Hynapene A

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ChEBI Name Hynapene A
ChEBI ID CHEBI:189255
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H28O5
Net Charge 0
Average Mass 324.417
Monoisotopic Mass 324.19367
InChI InChI=1S/C18H28O5/c1-10-8-11(2)15-13(9-10)17(22)16(21)12(3)18(15,23)7-5-4-6-14(19)20/h4-7,10-13,15-17,21-23H,8-9H2,1-3H3,(H,19,20)/b6-4+,7-5+
InChIKey NAXMPIYZDKZMMN-YDFGWWAZSA-N
SMILES OC1(C2C(C(O)C(O)C1C)CC(CC2C)C)/C=C/C=C/C(O)=O
Metabolite of Species Details
Arabidopsis thaliana (NCBI:txid3702) Found in leaf (BTO:0000713). 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 Hynapene A (CHEBI:189255) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
(2E,4E)-5-(1,3,4-trihydroxy-2,6,8-trimethyl-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-yl)penta-2,4-dienoic acid
Manual Xref Database
4947683 ChemSpider
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Registry Number Type Source
155111-89-0 CAS Registry Number ChemIDplus