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CHEBI:211447 - Gerronemin F

ChEBI IDCHEBI:211447
ChEBI NameGerronemin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H38O4
Net Charge0
Average Mass438.608
Monoisotopic Mass438.27701
SMILESOc1cccc(CCCC/C=C\C/C=C\CCCCCCCc2cccc(O)c2O)c1O
InChIInChI=1S/C28H38O4/c29-25-21-15-19-23(27(25)31)17-13-11-9-7-5-3-1-2-4-6-8-10-12-14-18-24-20-16-22-26(30)28(24)32/h1-2,5,7,15-16,19-22,29-32H,3-4,6,8-14,17-18H2/b2-1-,7-5-
InChIKeyQSKMIIVRMKYVQQ-PQZOIKATSA-N
Species of MetaboliteComponentSourceComments
Gerronemaspecies (ncbitaxon:2170365) - PubMed (11867096)
ChEBI Ontology
Outgoing Relation(s)
Gerronemin F (CHEBI:211447) is a catechols (CHEBI:33566)
IUPAC Name 
3-[(8Z,11Z)-16-(2,3-dihydroxyphenyl)hexadeca-8,11-dienyl]benzene-1,2-diol
Manual XrefsDatabases
4476423ChemSpider