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CHEBI:223473 - Hexahydromenaquinone MK-9(II,III,VIII-H6

ChEBI IDCHEBI:223473
ChEBI NameHexahydromenaquinone MK-9(II,III,VIII-H6
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC56H86O2
Net Charge0
Average Mass791.302
Monoisotopic Mass790.66278
SMILESCC(C)=CCCC(C)CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CCC(C)CCCC(C)CCC/C(C)=C/CC1=C(C)C(=O)c2ccccc2C1=O
InChIInChI=1S/C56H86O2/c1-42(2)22-14-23-43(3)24-15-25-44(4)26-16-27-45(5)28-17-29-46(6)30-18-31-47(7)32-19-33-48(8)34-20-35-49(9)36-21-37-50(10)40-41-52-51(11)55(57)53-38-12-13-39-54(53)56(52)58/h12-13,22,26,28,30,32,38-40,43,48-49H,14-21,23-25,27,29,31,33-37,41H2,1-11H3/b44-26+,45-28+,46-30+,47-32+,50-40+
InChIKeySIXKOEIRDRJZPQ-VFACPGNZSA-N
Species of MetaboliteComponentSourceComments
Natronobacterium gregoryi (ncbitaxon:44930) - DOI (10.1016/0378-1097(87)90417-4)
Roles Classification
Biological Roles:
fat-soluble vitamin (role)  Any vitamin that dissolves in fats and are stored in body tissues. Unlike the water-soluble vitamins, they are stored in the body for long periods of time and generally pose a greater risk for toxicity when consumed in excess.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
Hexahydromenaquinone MK-9(II,III,VIII-H6 (CHEBI:223473) is a vitamin K (CHEBI:28384)
IUPAC Name 
2-methyl-3-[(2E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,14,18,22,26,34-hexaenyl]naphthalene-1,4-dione
Manual XrefsDatabases
78444983ChemSpider