CHEBI:87161 - dihydrobisanhydrobacterioruberin

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ChEBI Name dihydrobisanhydrobacterioruberin ChEBI ID CHEBI:87161 Definition A C50 carotenoid that is an intermediate in the biosynthesis of bacterioruberin, a red-coloured pigment found in several Halobacterium and Haloarcula species. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C50H74O2 Net Charge 0 Average Mass 707.12140 Monoisotopic Mass 706.56888 InChI InChI=1S/C50H74O2/c1-39(2)31-35-47(49(11,12)51)37-33-45(9)29-19-27-43(7)25-17-23-41(5)21-15-16-22-42(6)24-18-26-44(8)28-20-30-46(10)34-38-48(50(13,14)52)36-32-40(3)4/h15-33,37,47-48,51-52H,34-36,38H2,1-14H3/b16-15+,23-17+,24-18+,27-19+,28-20+,37-33+,41-21+,42-22+,43-25+,44-26+,45-29+,46-30+/t47-,48-/m0/s1 InChIKey DBVNNKGZPLOLDX-VFYNWLBVSA-N SMILES CC(C)=CC[C@@H](CC\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)C(C)(C)O Metabolite of Species Details Haloarcula japonica (NCBI:txid29282) See: PubMed Roles Classification Biological Role(s): bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. View more via ChEBI Ontology ChEBI Ontology Outgoing dihydrobisanhydrobacterioruberin (CHEBI:87161) has role bacterial metabolite (CHEBI:76969) dihydrobisanhydrobacterioruberin (CHEBI:87161) is a C50 carotenoid (CHEBI:87165) dihydrobisanhydrobacterioruberin (CHEBI:87161) is a diol (CHEBI:23824) dihydrobisanhydrobacterioruberin (CHEBI:87161) is a tertiary alcohol (CHEBI:26878) IUPAC Name (3S,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E,30R)-2,6,10,14,19,23,27,31-octamethyl-3,30-bis(3-methylbut-2-en-1-yl)dotriaconta-4,6,8,10,12,14,16,18,20,22,24,26-dodecaene-2,31-diol Synonym Source dihydrobisanhydrobacterioruberin UniProt Manual Xref Database CPD-18007 MetaCyc View more database links Citation Type Source 25712483 PubMed citation SUBMITTER Last Modified 11 August 2015