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CHEBI:80167 - chlorobactene

ChEBI IDCHEBI:80167
ChEBI Namechlorobactene
Stars
DefinitionA carotenoid that is 1,2,4-trimethylmenzene in which the hydrogen at position 3 has been replaced by an all-trans-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,23-undecaen-1-yl group. Found in photosynthetic green bacteria.
Last Modified21 September 2017
DownloadsMolfile
FormulaC40H52
Net Charge0
Average Mass532.856
Monoisotopic Mass532.40690
SMILESCC(C)=CCC/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/c1c(C)ccc(C)c1C
InChIInChI=1S/C40H52/c1-31(2)17-13-20-34(5)23-15-25-35(6)24-14-21-32(3)18-11-12-19-33(4)22-16-26-36(7)27-30-40-38(9)29-28-37(8)39(40)10/h11-12,14-19,21-30H,13,20H2,1-10H3/b12-11+,21-14+,22-16+,25-15+,30-27+,32-18+,33-19+,34-23+,35-24+,36-26+
InChIKeyVJASLAGEYVTOGS-IQAIWTHGSA-N
Species of MetaboliteComponentSourceComments
Chlorobium limicola (ncbitaxon:1092) - Article (Acta Chem. Scand., 1964, 18, 1703)
Desulfuromonas acetoxidans (ncbitaxon:891) - Article (Acta Chem. Scand., 1964, 18, 1703)
Chlorobium vibrioforme f. thiosulfatophilum (ncbitaxon:115853) - Article (Acta Chem. Scand., 1964, 18, 1703)
Chlorobaculum tepidum (ncbitaxon:1097) - PubMed (16923888)
Chlorobaculum macestae (ncbitaxon:44314) - PubMed (18365725) Strain: Strain M
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
chlorobactene (CHEBI:80167) has role bacterial metabolite (CHEBI:76969)
chlorobactene (CHEBI:80167) is a benzenes (CHEBI:22712)
chlorobactene (CHEBI:80167) is a carotenoid (CHEBI:23044)
chlorobactene (CHEBI:80167) is a carotenoid φ-end group (CHEBI:139129)
IUPAC Name 
φ,ψ-carotene
Synonym  Source
trans-chlorobacteneChEBI
Manual XrefsDatabases
C15908KEGG COMPOUND
C00022819KNApSAcK
LMPR01070163LIPID MAPS
Registry NumbersSources
Reaxys:2489575Reaxys
CAS:2932-09-4KEGG COMPOUND
CAS:2932-09-4ChemIDplus
Citations