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CHEBI:80214 - 3'-hydroxyechinenone

ChEBI IDCHEBI:80214
ChEBI Name3'-hydroxyechinenone
Stars
DefinitionA member of the class of carotenone that is echinenone carrying an additional hydroxy substituent at position 3'. Found in cyanobacteria.
Last Modified25 August 2015
DownloadsMolfile
FormulaC40H54O2
Net Charge0
Average Mass566.870
Monoisotopic Mass566.41238
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)CCC2(C)C)C(C)(C)C[C@H](O)C1
InChIInChI=1S/C40H54O2/c1-29(17-13-19-31(3)21-23-36-33(5)27-35(41)28-40(36,9)10)15-11-12-16-30(2)18-14-20-32(4)22-24-37-34(6)38(42)25-26-39(37,7)8/h11-24,35,41H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-/m1/s1
InChIKeyZRCXVNZZDQGBQT-BANQPSJHSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Synechocystis sp. (ncbitaxon:1148) - PubMed (24846130) Strain: PCC 6803
Roles Classification
Biological Roles:
cofactor  An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group).
biological pigment  An endogenous molecular entity that results in a colour of an organism as the consequence of the selective absorption of light.
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
3'-hydroxyechinenone (CHEBI:80214) has functional parent echinenone (CHEBI:4746)
3'-hydroxyechinenone (CHEBI:80214) has role bacterial metabolite (CHEBI:76969)
3'-hydroxyechinenone (CHEBI:80214) has role biological pigment (CHEBI:26130)
3'-hydroxyechinenone (CHEBI:80214) has role cofactor (CHEBI:23357)
3'-hydroxyechinenone (CHEBI:80214) is a carotenone (CHEBI:35310)
3'-hydroxyechinenone (CHEBI:80214) is a enone (CHEBI:51689)
3'-hydroxyechinenone (CHEBI:80214) is a secondary alcohol (CHEBI:35681)
IUPAC Name 
(3'R)-3'-hydroxy-β,β-caroten-4-one
Synonyms  Source
3'-OH-EchinenoneLIPID MAPS
HEQChEBI
hECNChEBI
3'-hydroxy-β,β-caroten-4-oneChEBI
(3'R)-3'-hydroxy-echinenoneChEBI
3-{(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl}-2,4,4-trimethylcyclohex-2-en-1-oneIUPAC
UniProt Name  Source
3'-hydroxyechinenoneUniProt
Manual XrefsDatabases
C15965KEGG COMPOUND
LMPR01070098LIPID MAPS
3%27-HydroxyechinenoneWikipedia
Registry NumbersSources
Reaxys:6024554Reaxys
Citations