CHEBI:207699 - Homoharzianic acid

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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 Homoharzianic acid
ChEBI ID CHEBI:207699
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H29NO6
Net Charge 0
Average Mass 379.453
Monoisotopic Mass 379.19949
InChI InChI=1S/C20H29NO6/c1-5-7-8-9-10-11-15(22)16-17(23)14(21(4)18(16)24)12-20(27,19(25)26)13(3)6-2/h8-11,13-14,22,27H,5-7,12H2,1-4H3,(H,25,26)/b9-8+,11-10+,16-15+
InChIKey AVRTULLFONHWCY-YTSHIELPSA-N
SMILES O=C\1N(C(CC(O)(C(=O)O)C(CC)C)C(/C1=C(\O)/C=C/C=C/CCC)=O)C
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 Homoharzianic acid (CHEBI:207699) is a heterocyclic fatty acid (CHEBI:48847)
IUPAC Name
2-hydroxy-2-[[(4E)-4-[(2E,4E)-1-hydroxyocta-2,4-dienylidene]-1-methyl-3,5-dioxopyrrolidin-2-yl]methyl]-3-methylpentanoic acid
Manual Xref Database
78443647 ChemSpider
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