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CHEBI:169747 - Methyl (9Z)-10'-oxo-6,10'-diapo-6-carotenoate

ChEBI IDCHEBI:169747
ChEBI NameMethyl (9Z)-10'-oxo-6,10'-diapo-6-carotenoate
Stars
Last Modified7 June 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24O3
Net Charge0
Average Mass312.409
Monoisotopic Mass312.17254
SMILESCOC(=O)/C=C/C(C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=O
InChIInChI=1S/C20H24O3/c1-17(9-5-6-10-18(2)13-8-16-21)11-7-12-19(3)14-15-20(22)23-4/h5-16H,1-4H3/b6-5+,11-7+,13-8+,15-14+,17-9+,18-10+,19-12-
InChIKeyNXZZZYUALZNGOO-OKMAZBOSSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Methyl (9Z)-10'-oxo-6,10'-diapo-6-carotenoate (CHEBI:169747) is a polyunsaturated fatty aldehyde (CHEBI:72692)
IUPAC Name 
methyl (2E,4Z,6E,8E,10E,12E,14E)-4,8,13-trimethyl-16-oxohexadeca-2,4,6,8,10,12,14-heptaenoate
Manual XrefsDatabases
30776928ChemSpider
HMDB0031976HMDB