CHEBI:28377 - plastoquinone-9

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ChEBI Name plastoquinone-9 ChEBI ID CHEBI:28377 Definition A plastoquinone in which the number of isoprene units in the side chain is 9. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:8263, CHEBI:26162 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 C53H80O2 Net Charge 0 Average Mass 749.20110 Monoisotopic Mass 748.61583 InChI InChI=1S/C53H80O2/c1-40(2)21-13-22-41(3)23-14-24-42(4)25-15-26-43(5)27-16-28-44(6)29-17-30-45(7)31-18-32-46(8)33-19-34-47(9)35-20-36-48(10)37-38-51-39-52(54)49(11)50(12)53(51)55/h21,23,25,27,29,31,33,35,37,39H,13-20,22,24,26,28,30,32,34,36,38H2,1-12H3/b41-23+,42-25+,43-27+,44-29+,45-31+,46-33+,47-35+,48-37+ InChIKey FKUYMLZIRPABFK-IQSNHBBHSA-N SMILES CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC1=CC(=O)C(C)=C(C)C1=O ChEBI Ontology Outgoing plastoquinone-9 (CHEBI:28377) is a plastoquinone (CHEBI:17757) IUPAC Name 2,3-dimethyl-5-[(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-yl]cyclohexa-2,5-diene-1,4-dione Synonyms Sources (all-E)-2,3-dimethyl-5-(3,7,11,15,19,23,27,31,35-nonamethyl-2,6,10,14,18,22,26,30,34-hexatricontanonaenyl)-2,5-cyclohexadiene-1-4-dione ChEBI 2,3-dimethyl-5-(solanesyl)-1,4-benzoquinone ChEBI Kofler's quinone ChEBI plastoquinone 45 ChEBI plastoquinone A KEGG COMPOUND Plastoquinone-9 KEGG COMPOUND plastoquinone-9 UniProt PQ-9 ChEBI Manual Xrefs Databases C00002851 KNApSAcK C10385 KEGG COMPOUND PLASTOQUINONE-9 MetaCyc View more database links Registry Numbers Types Sources 1899419 Reaxys Registry Number Reaxys 4299-57-4 CAS Registry Number KEGG COMPOUND 4299-57-4 CAS Registry Number ChemIDplus Last Modified 28 July 2014