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CHEBI:197074 - Alopecurone G

ChEBI IDCHEBI:197074
ChEBI NameAlopecurone G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H30O5
Net Charge0
Average Mass422.521
Monoisotopic Mass422.20932
SMILES[H][C@@]1(c2ccc(O)cc2OC)CC(=O)c2ccc(O)c(C[C@@H](CC=C(C)C)C(=C)C)c2O1
InChIInChI=1S/C26H30O5/c1-15(2)6-7-17(16(3)4)12-21-22(28)11-10-19-23(29)14-25(31-26(19)21)20-9-8-18(27)13-24(20)30-5/h6,8-11,13,17,25,27-28H,3,7,12,14H2,1-2,4-5H3/t17-,25+/m1/s1
InChIKeyVRMRECOMNBQHJO-NSYGIPOTSA-N
Species of MetaboliteComponentSourceComments
Cannabis sativa (ncbitaxon:3483) inflorescence (BTO:0000628) MetaboLights (MTBLS6032) Strain: Cannabis sativa var. DMG265
ChEBI Ontology
Outgoing Relation(s)
Alopecurone G (CHEBI:197074) is a flavanones (CHEBI:28863)
IUPAC Name 
(2S)-7-hydroxy-2-(4-hydroxy-2-methoxyphenyl)-8-[(2R)-5-methyl-2-prop-1-en-2-ylhex-4-enyl]-2,3-dihydrochromen-4-one
Manual XrefsDatabases
LMPK12140080LIPID MAPS
24846253ChemSpider