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CHEBI:225247 - 2'-methoxy-1'-hydroxy-beta,psi-caroten-4-one

ChEBI IDCHEBI:225247
ChEBI Name2'-methoxy-1'-hydroxy-beta,psi-caroten-4-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H56O3
Net Charge0
Average Mass596.896
Monoisotopic Mass596.42295
SMILESCO[C@H](/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)CCC1(C)C)C(C)(C)O
InChIInChI=1S/C41H56O3/c1-31(19-14-21-33(3)22-16-24-35(5)26-28-39(44-11)41(9,10)43)17-12-13-18-32(2)20-15-23-34(4)25-27-37-36(6)38(42)29-30-40(37,7)8/h12-28,39,43H,29-30H2,1-11H3/b13-12+,19-14+,20-15+,22-16+,27-25+,28-26+,31-17+,32-18+,33-21+,34-23+,35-24+/t39-/m1/s1
InChIKeyJSNJWVUHVVIVLK-MOIPWTMGSA-N
Species of MetaboliteComponentSourceComments
Hymenobacterspecies (ncbitaxon:1898978) - DOI (10.1016/j.tetlet.2009.03.117)
ChEBI Ontology
Outgoing Relation(s)
2'-methoxy-1'-hydroxy-beta,psi-caroten-4-one (CHEBI:225247) is a xanthophyll (CHEBI:27325)
IUPAC Name 
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
78435488ChemSpider