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CHEBI:172782 - 6-Geranylgeranyl 8'-methyl 6,8'-diapocarotene-6,8'-dioate

ChEBI IDCHEBI:172782
ChEBI Name6-Geranylgeranyl 8'-methyl 6,8'-diapocarotene-6,8'-dioate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H60O4
Net Charge0
Average Mass640.949
Monoisotopic Mass640.44916
SMILESCOC(=O)/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C(=O)OC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C43H60O4/c1-34(2)18-13-21-37(5)23-14-24-38(6)25-16-27-40(8)32-33-47-42(44)31-30-39(7)26-15-22-35(3)19-11-12-20-36(4)28-17-29-41(9)43(45)46-10/h11-12,15,17-20,22-23,25-26,28-32H,13-14,16,21,24,27,33H2,1-10H3/b12-11+,22-15+,28-17+,31-30+,35-19+,36-20+,37-23+,38-25+,39-26+,40-32+,41-29+
InChIKeyKJAWBWQJDQHEDL-KQTSZGLPSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
6-Geranylgeranyl 8'-methyl 6,8'-diapocarotene-6,8'-dioate (CHEBI:172782) is a diterpenoid (CHEBI:23849)
IUPAC Name 
1-O-methyl 18-O-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl] (2E,4E,6E,8E,10E,12E,14E,16E)-2,6,11,15-tetramethyloctadeca-2,4,6,8,10,12,14,16-octaenedioate
Manual XrefsDatabases
HMDB0034770HMDB
30777066ChemSpider