CHEBI:172562 - 5-Deoxymyricanone

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 5-Deoxymyricanone
ChEBI ID CHEBI:172562
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H24O4
Net Charge 0
Average Mass 340.419
Monoisotopic Mass 340.16746
InChI InChI=1S/C21H24O4/c1-24-20-13-15-5-3-4-6-16(22)9-7-14-8-10-19(23)17(11-14)18(12-15)21(20)25-2/h8,10-13,23H,3-7,9H2,1-2H3
InChIKey UCIYWYZLILBGOL-UHFFFAOYSA-N
SMILES O(C1=C2C=3C=C(CCC(=O)CCCCC(=C2)C=C1OC)C=CC3O)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing 5-Deoxymyricanone (CHEBI:172562) is a biphenyls (CHEBI:22888)
IUPAC Name
3-hydroxy-16,17-dimethoxytricyclo[12.3.1.12,6]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-9-one
Manual Xrefs Databases
10273166 ChemSpider
HMDB0030799 HMDB
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