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CHEBI:188860 - terpecurcumin B

ChEBI IDCHEBI:188860
ChEBI Nameterpecurcumin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H44O7
Net Charge0
Average Mass588.741
Monoisotopic Mass588.30870
SMILES[H][C@]1([C@@H](C)CCC=C(C)C)C[C@H](Oc2ccc(/C=C/C(O)=C/C(=O)/C=C/c3ccc(O)c(OC)c3)cc2OC)C(C)=C[C@@H]1O
InChIInChI=1S/C36H44O7/c1-23(2)8-7-9-24(3)30-22-34(25(4)18-32(30)40)43-33-17-13-27(20-36(33)42-6)11-15-29(38)21-28(37)14-10-26-12-16-31(39)35(19-26)41-5/h8,10-21,24,30,32,34,38-40H,7,9,22H2,1-6H3/b14-10+,15-11+,29-21-/t24-,30+,32-,34-/m0/s1
InChIKeyWLFPRMQOFUMWBP-WXJREWSDSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
terpecurcumin B (CHEBI:188860) is a diarylheptanoid (CHEBI:78802)
IUPAC Name 
(1E,4Z,6E)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-7-[4-[(1S,4R,5R)-4-hydroxy-2-methyl-5-[(2S)-6-methylhept-5-en-2-yl]cyclohex-2-en-1-yl]oxy-3-methoxyphenyl]hepta-1,4,6-trien-3-one
Manual XrefsDatabases
28536061ChemSpider