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CHEBI:172624 - 6,7-Dimethoxy-7-epirosmanol

ChEBI IDCHEBI:172624
ChEBI Name6,7-Dimethoxy-7-epirosmanol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H30O6
Net Charge0
Average Mass390.476
Monoisotopic Mass390.20424
SMILESCOC1c2cc(C(C)C)c(O)c(O)c2C23CCCC(C)(C)C2C1(OC)OC3=O
InChIInChI=1S/C22H30O6/c1-11(2)12-10-13-14(16(24)15(12)23)21-9-7-8-20(3,4)18(21)22(27-6,17(13)26-5)28-19(21)25/h10-11,17-18,23-24H,7-9H2,1-6H3
InChIKeyMCHRWEBHSKWYBW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
6,7-Dimethoxy-7-epirosmanol (CHEBI:172624) is a diterpene lactone (CHEBI:49193)
IUPAC Name 
3,4-dihydroxy-8,9-dimethoxy-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
35013272ChemSpider
HMDB0030844HMDB