Harzianoic acid A (CHEBI:227223)

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CHEBI:227223 - Harzianoic acid A

Default Structure

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ChEBI ID	CHEBI:227223
ChEBI Name	Harzianoic acid A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C14H20O5
Net Charge	0
Average Mass	268.309
Monoisotopic Mass	268.13107
SMILES	CC(=O)[C@@H]1C[C@H](C(=O)O)[C@@]1(C)CCC=C(C)C(=O)O
InChI	InChI=1S/C14H20O5/c1-8(12(16)17)5-4-6-14(3)10(9(2)15)7-11(14)13(18)19/h5,10-11H,4,6-7H2,1-3H3,(H,16,17)(H,18,19)/t10-,11+,14-/m0/s1
InChIKey	UDZRBDXBUYNBCW-WDMOLILDSA-N

Species of Metabolite	Component	Source	Comments
Trichoderma harzianum (ncbitaxon:5544)	-	PubMed (30606673)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	Harzianoic acid A (CHEBI:227223) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name
(1S,2S,3R)-3-acetyl-2-(4-carboxypent-3-enyl)-2-methylcyclobutane-1-carboxylic acid