CHEBI:177119 - 1-[2,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-2-hydroxy-3-[4-hydroxy-3-methoxy-5-(3-methylbut-2-en-1-yl)phenyl]propan-1-one

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ChEBI Name 1-[2,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-2-hydroxy-3-[4-hydroxy-3-methoxy-5-(3-methylbut-2-en-1-yl)phenyl]propan-1-one
ChEBI ID CHEBI:177119
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H32O6
Net Charge 0
Average Mass 440.536
Monoisotopic Mass 440.21989
InChI InChI=1S/C26H32O6/c1-15(2)6-8-18-13-20(22(28)14-21(18)27)26(31)23(29)11-17-10-19(9-7-16(3)4)25(30)24(12-17)32-5/h6-7,10,12-14,23,27-30H,8-9,11H2,1-5H3
InChIKey NFPXWNKRWGQIQV-UHFFFAOYSA-N
SMILES OC(CC1=CC(CC=C(C)C)=C(O)C(OC)=C1)C(=O)C=2C=C(CC=C(C)C)C(O)=CC2O
Metabolite of Species Details
Bos grunniens (NCBI:txid30521) Found in subcutaneous adipose tissue (BTO:0004042).
ChEBI Ontology
Outgoing 1-[2,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-2-hydroxy-3-[4-hydroxy-3-methoxy-5-(3-methylbut-2-en-1-yl)phenyl]propan-1-one (CHEBI:177119) is a chalcones (CHEBI:23086)
IUPAC Name
1-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-2-hydroxy-3-[4-hydroxy-3-methoxy-5-(3-methylbut-2-enyl)phenyl]propan-1-one
Manual Xrefs Databases
74853242 ChemSpider
HMDB0133250 HMDB
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