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CHEBI:204755 - 2'-methoxy-3,1'-dihydroxy-beta,psi-caroten-4-one

ChEBI IDCHEBI:204755
ChEBI Name2'-methoxy-3,1'-dihydroxy-beta,psi-caroten-4-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H56O4
Net Charge0
Average Mass612.895
Monoisotopic Mass612.41786
SMILESCOC(/C=C/C(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C(=O)C(O)CC1(C)C)C(C)(C)O
InChIInChI=1S/C41H56O4/c1-30(19-14-21-32(3)22-16-24-34(5)26-28-38(45-11)41(9,10)44)17-12-13-18-31(2)20-15-23-33(4)25-27-36-35(6)39(43)37(42)29-40(36,7)8/h12-28,37-38,42,44H,29H2,1-11H3/b13-12+,19-14+,20-15+,22-16+,27-25+,28-26+,30-17+,31-18+,32-21+,33-23+,34-24+
InChIKeyAXNMZTXBDMIOQI-PLZORGLKSA-N
Species of MetaboliteComponentSourceComments
Hymenobacterspecies (ncbitaxon:1898978) - DOI (10.1016/j.tetlet.2009.03.117)
ChEBI Ontology
Outgoing Relation(s)
2'-methoxy-3,1'-dihydroxy-beta,psi-caroten-4-one (CHEBI:204755) is a xanthophyll (CHEBI:27325)
IUPAC Name 
6-hydroxy-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E,21E)-24-hydroxy-23-methoxy-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,21-undecaenyl]-2,4,4-trimethylcyclohex-2-en-1-one
Manual XrefsDatabases
78435461ChemSpider