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CHEBI:228014 - Cosmosporin A

ChEBI IDCHEBI:228014
ChEBI NameCosmosporin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H34O4
Net Charge0
Average Mass362.510
Monoisotopic Mass362.24571
SMILESC/C(=C\Cc1c(O)cc(C)cc1O)CC/C=C(\C)CC[C@@H](O)C(C)(C)O
InChIInChI=1S/C22H34O4/c1-15(9-11-18-19(23)13-17(3)14-20(18)24)7-6-8-16(2)10-12-21(25)22(4,5)26/h8-9,13-14,21,23-26H,6-7,10-12H2,1-5H3/b15-9+,16-8+/t21-/m1/s1
InChIKeyUTVRMYTWZUFVGI-SDJVXUTESA-N
Species of MetaboliteComponentSourceComments
Pseudocosmospora (ncbitaxon:1406987) - DOI (10.1016/j.phytol.2019.03.014)
ChEBI Ontology
Outgoing Relation(s)
Cosmosporin A (CHEBI:228014) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
2-[(2E,6E,10R)-10,11-dihydroxy-3,7,11-trimethyldodeca-2,6-dienyl]-5-methylbenzene-1,3-diol