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CHEBI:208144 - Antroquinonol R

ChEBI IDCHEBI:208144
ChEBI NameAntroquinonol R
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H36O6
Net Charge0
Average Mass408.535
Monoisotopic Mass408.25119
SMILESCOC1=C(O)[C@H](C)[C@@H](CC=C(C)CCC=C(C)C[C@H](O)C=C(C)CO)[C@@H](O)C1=O
InChIInChI=1S/C23H36O6/c1-14(7-6-8-15(2)11-18(25)12-16(3)13-24)9-10-19-17(4)20(26)23(29-5)22(28)21(19)27/h8-9,12,17-19,21,24-27H,6-7,10-11,13H2,1-5H3/t17-,18+,19-,21-/m1/s1
InChIKeyYGOVUEFRDLADKX-RCLSDMTESA-N
Species of MetaboliteComponentSourceComments
Antrodia cinnamomea (ncbitaxon:279009) - PubMed (28898082)
ChEBI Ontology
Outgoing Relation(s)
Antroquinonol R (CHEBI:208144) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(4R,5R,6R)-5-[(9S)-9,12-dihydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl]-3,6-dihydroxy-2-methoxy-4-methylcyclohex-2-en-1-one
Manual XrefsDatabases
78441662ChemSpider