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2-decaprenyl-6-methoxy-3-methyl-1,4-benzoquinone

Properties

Image

Occurences in reactions

MNX_ID

MNXM9803

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	2

formula

C₅₈H₈₈O₃

charge

mass

832.67335

reference

chebi:50772

InChIKey

DLBRMPAESNEOJM-RGIWONJESA-N

InChI

InChI=1S/C58H88O3/c1-44(2)23-14-24-45(3)25-15-26-46(4)27-16-28-47(5)29-17-30-48(6)31-18-32-49(7)33-19-34-50(8)35-20-36-51(9)37-21-38-52(10)39-22-40-53(11)41-42-55-54(12)56(59)43-57(61-13)58(55)60/h23,25,27,29,31,33,35,37,39,41,43H,14-22,24,26,28,30,32,34,36,38,40,42H2,1-13H3/b45-25+,46-27+,47-29+,48-31+,49-33+,50-35+,51-37+,52-39+,53-41+

SMILES

COC1=CC(=O)C(C)=C(C/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)CC/C=C(\C)CCC=C(C)C)C1=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:50772 chebi:50772	2-decaprenyl-6-methoxy-3-methyl-1,4-benzoquinone 3-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]-5-methoxy-2-methyl-1,4-benzoquinone 3-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]-5-methoxy-2-methylcyclohexa-2,5-diene-1,4-dione 5-demethoxyubiquinone-10
bigg.metabolite:2dp6mobq_me biggM:2dp6mobq_me	2-Decaprenyl-3-methyl-6-methoxy-1,4-benzoquinone
hmdb:HMDB0060251	2-Decaprenyl-6-methoxy-3-methyl-1,4-benzoquinone 3-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-Decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]-5-methoxy-2-methyl-1,4-benzoquinone 3-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]-5-methoxy-2-methylcyclohexa-2,5-diene-1,4-dione 5-Demethoxyubiquinone-10
metacyc.compound:CPD-11660 metacycM:CPD-11660 seed.compound:cpd23044 seedM:cpd23044	2-decaprenyl-3-methyl-6-methoxy-1,4-benzoquinone
lipidmaps:LMPR02010032 lipidmapsM:LMPR02010032	2-decaprenyl-6-methoxy-3-methyl-1,4-benzoquinone 3-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-yl]-5-methoxy-2-methylcyclohexa-2,5-diene-1,4-dione
hmdb:HMDB60251 biggM:M_2dp6mobq_me seedM:M_cpd23044	secondary/obsolete/fantasy identifier