6-carboxycosmosporin A (CHEBI:228016)

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CHEBI:228016 - 6-carboxycosmosporin A

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ChEBI ID	CHEBI:228016
ChEBI Name	6-carboxycosmosporin A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C23H34O6
Net Charge	0
Average Mass	406.519
Monoisotopic Mass	406.23554
SMILES	C/C(=C\Cc1c(O)cc(C)c(C(=O)O)c1O)CC/C=C(\C)CC[C@@H](O)C(C)(C)O
InChI	InChI=1S/C23H34O6/c1-14(7-6-8-15(2)10-12-19(25)23(4,5)29)9-11-17-18(24)13-16(3)20(21(17)26)22(27)28/h8-9,13,19,24-26,29H,6-7,10-12H2,1-5H3,(H,27,28)/b14-9+,15-8+/t19-/m1/s1
InChIKey	CWSUETWLMHLISD-OVXWBWHVSA-N

Species of Metabolite	Component	Source	Comments
Pseudocosmospora (ncbitaxon:1406987)	-	DOI (10.1016/j.phytol.2019.03.014)

ChEBI Ontology

Outgoing Relation(s)
	6-carboxycosmosporin A (CHEBI:228016) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name
3-[(2E,6E,10R)-10,11-dihydroxy-3,7,11-trimethyldodeca-2,6-dienyl]-2,4-dihydroxy-6-methylbenzoic acid