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CHEBI:8191 - all-trans-phytoene

ChEBI IDCHEBI:8191
ChEBI Nameall-trans-phytoene
Stars
ASCII Nameall-trans-phytoene
DefinitionThe all-trans-isomer of phytoene.
Last Modified23 October 2015
DownloadsMolfile
FormulaC40H64
Net Charge0
Average Mass544.952
Monoisotopic Mass544.50080
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/C=C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+
InChIKeyYVLPJIGOMTXXLP-KEKOKYSKSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
all-trans-phytoene (CHEBI:8191) has role plant metabolite (CHEBI:76924)
all-trans-phytoene (CHEBI:8191) is a phytoene (CHEBI:26119)
IUPAC Name 
7,8,11,12,7',8',11',12'-octahydro-ψ,ψ-carotene
Synonyms  Source
PhytoeneKEGG COMPOUND
7,7',8,8',11,11',12,12'-octahydro-ψ,ψ-caroteneChemIDplus
(6E,10E,14E,16E,18E,22E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,14,16,18,22,26,30-nonaeneIUPAC
UniProt Name  Source
all-trans-phytoeneUniProt
Manual XrefsDatabases
C05413KEGG COMPOUND
LMPR01070254LIPID MAPS
PHYTOENEMetaCyc
HMDB0002181HMDB
Registry NumbersSources
Reaxys:1845455Reaxys
CAS:540-04-5ChemIDplus
Citations