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CHEBI:174829 - 7-Methylrosmanol

ChEBI IDCHEBI:174829
ChEBI Name7-Methylrosmanol
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28O5
Net Charge0
Average Mass360.450
Monoisotopic Mass360.19367
SMILESCOC1c2cc(C(C)C)c(O)c(O)c2C23CCCC(C)(C)C2C1OC3=O
InChIInChI=1S/C21H28O5/c1-10(2)11-9-12-13(15(23)14(11)22)21-8-6-7-20(3,4)18(21)17(16(12)25-5)26-19(21)24/h9-10,16-18,22-23H,6-8H2,1-5H3
InChIKeyXNPVHIQPSAZTLC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7-Methylrosmanol (CHEBI:174829) is a diterpene lactone (CHEBI:49193)
IUPAC Name 
3,4-dihydroxy-8-methoxy-11,11-dimethyl-5-propan-2-yl-16-oxatetracyclo[7.5.2.01,10.02,7]hexadeca-2,4,6-trien-15-one
Manual XrefsDatabases
8126384ChemSpider
HMDB0035813HMDB