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menaquinone-9

Properties

Image

Occurences in reactions

MNX_ID

MNXM19280

	#reac
in my sandbox	0
in MNXref (generic)	19
in models (compartimentalized)	4

formula

C₅₆H₈₀O₂

charge

mass

784.61583

reference

chebi:44147

InChIKey

WCRXHNIUHQUASO-UVZVDVBNSA-N

InChI

InChI=1S/C56H80O2/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/h12-13,22,24,26,28,30,32,34,36,38-40H,14-21,23,25,27,29,31,33,35,37,41H2,1-11H3/b43-24+,44-26+,45-28+,46-30+,47-32+,48-34+,49-36+,50-40+

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=C(C)C(=O)c2ccccc2C1=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:44147 chebi:44147	menaquinone-9 MK-9 MK9 Menaquinone 9 menaquinone with nine isoprene units
seed.compound:cpd25794 seedM:cpd25794	MK-9 MK9 menaquinone-9
bigg.metabolite:mqn9 biggM:mqn9 kegg.compound:C21526 keggC:C21526	Menaquinone-9
lipidmaps:LMPR02010041 lipidmapsM:LMPR02010041	Menaquinone-9 2-methyl-3-((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-nonaenyl)naphthalene-1,4-dione MK-9
metacyc.compound:CPD-9720 metacycM:CPD-9720	menaquinone-9 MK-9 MK9
biggM:M_mqn9 keggC:M_C21526 seedM:M_cpd25794	secondary/obsolete/fantasy identifier