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CHEBI:216137 - Mariline B

ChEBI IDCHEBI:216137
ChEBI NameMariline B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H33NO4
Net Charge0
Average Mass387.520
Monoisotopic Mass387.24096
SMILESCOc1c(C)c(OCC=C(C)CCC=C(C)C)cc2c1C(=O)N(CCO)[C@H]2C
InChIInChI=1S/C23H33NO4/c1-15(2)8-7-9-16(3)10-13-28-20-14-19-18(5)24(11-12-25)23(26)21(19)22(27-6)17(20)4/h8,10,14,18,25H,7,9,11-13H2,1-6H3/t18-/m0/s1
InChIKeyIDKSCTLOZOTDPO-SFHVURJKSA-N
Species of MetaboliteComponentSourceComments
Stachylidium (ncbitaxon:796327) - PubMed (22711513)
ChEBI Ontology
Outgoing Relation(s)
Mariline B (CHEBI:216137) is a isoindoles (CHEBI:24897)
IUPAC Name 
5-(3,7-dimethylocta-2,6-dienoxy)-2-(2-hydroxyethyl)-7-methoxy-3,6-dimethyl-3H-isoindol-1-one
Manual XrefsDatabases
78435974ChemSpider