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CHEBI:64834 - menaquinol-7

ChEBI IDCHEBI:64834
ChEBI Namemenaquinol-7
Stars
DefinitionA menaquinol whose structure comprises a 2-methylbenzohydroquinone nucleus and a side chain of seven isoprenoid units.
Last Modified30 July 2012
SubmitterEugeni Belda
DownloadsMolfile
FormulaC46H66O2
Net Charge0
Average Mass651.032
Monoisotopic Mass650.50628
SMILESCC(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/Cc1c(C)c(O)c2ccccc2c1O
InChIInChI=1S/C46H66O2/c1-34(2)18-12-19-35(3)20-13-21-36(4)22-14-23-37(5)24-15-25-38(6)26-16-27-39(7)28-17-29-40(8)32-33-42-41(9)45(47)43-30-10-11-31-44(43)46(42)48/h10-11,18,20,22,24,26,28,30-32,47-48H,12-17,19,21,23,25,27,29,33H2,1-9H3/b35-20+,36-22+,37-24+,38-26+,39-28+,40-32+
InChIKeyVFGNPJRRTKMYKN-LJWNYQGCSA-N
Roles Classification
Chemical Role:
electron donor  A molecular entity that can transfer an electron to another molecular entity.
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
menaquinol-7 (CHEBI:64834) has role electron donor (CHEBI:15022)
menaquinol-7 (CHEBI:64834) is a menaquinol (CHEBI:18151)
IUPAC Name 
2-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]-3-methylnaphthalene-1,4-diol
Synonyms  Source
menaquinol(7)MetaCyc
MKH2-7MetaCyc
UniProt Name  Source
menaquinol-7UniProt
Manual XrefsDatabases
CPD-12125MetaCyc
Registry NumbersSources
Reaxys:3087757Reaxys
CAS:39776-47-1Reaxys