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CHEBI:87162 - isopentenyldehydrorhodopin

ChEBI IDCHEBI:87162
ChEBI Nameisopentenyldehydrorhodopin
Stars
DefinitionA C45 carotenoid that is an intermediate in the biosynthesis of bacterioruberin, a red-coloured pigment found in several Halobacterium and Haloarcula species
Last Modified29 September 2017
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC45H64O
Net Charge0
Average Mass621.006
Monoisotopic Mass620.49572
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/C=C(C)/C=C/[C@H](CC=C(C)C)C(C)(C)O
InChIInChI=1S/C45H64O/c1-36(2)20-15-23-40(7)26-18-29-41(8)27-16-24-38(5)21-13-14-22-39(6)25-17-28-42(9)30-19-31-43(10)33-35-44(45(11,12)46)34-32-37(3)4/h13-14,16-22,24-33,35,44,46H,15,23,34H2,1-12H3/b14-13+,24-16+,25-17+,29-18+,30-19+,35-33+,38-21+,39-22+,40-26+,41-27+,42-28+,43-31+/t44-/m0/s1
InChIKeyKMABSCJZIWNFFA-MBGUUZMHSA-N
Species of MetaboliteComponentSourceComments
Haloarcula japonica (ncbitaxon:29282) - PubMed (25712483)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
isopentenyldehydrorhodopin (CHEBI:87162) has role bacterial metabolite (CHEBI:76969)
isopentenyldehydrorhodopin (CHEBI:87162) is a C45 carotenoid (CHEBI:87168)
isopentenyldehydrorhodopin (CHEBI:87162) is a tertiary alcohol (CHEBI:26878)
Synonym  Source
(3S,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyl-3-(3-methylbut-2-en-1-yl)dotriaconta-4,6,8,10,12,14,16,18,20,22,24,26,30-tridecaen-2-olIUPAC
UniProt Name  Source
isopentenyldehydrorhodopinUniProt
Manual XrefsDatabases
CPD-18006MetaCyc
Citations