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3-demethylubiquinol-10

Properties

Image

Occurences in reactions

MNX_ID

MNXM36398

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	2

formula

C₅₈H₉₀O₄

charge

mass

850.68391

reference

chebi:64182

InChIKey

VLMQNHNMQVLPQI-AVRCVIBKSA-N

InChI

InChI=1S/C58H90O4/c1-43(2)23-14-24-44(3)25-15-26-45(4)27-16-28-46(5)29-17-30-47(6)31-18-32-48(7)33-19-34-49(8)35-20-36-50(9)37-21-38-51(10)39-22-40-52(11)41-42-54-53(12)55(59)57(61)58(62-13)56(54)60/h23,25,27,29,31,33,35,37,39,41,59-61H,14-22,24,26,28,30,32,34,36,38,40,42H2,1-13H3/b44-25+,45-27+,46-29+,47-31+,48-33+,49-35+,50-37+,51-39+,52-41+

SMILES

COc1c(O)c(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)c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-2162212 reactomeM:R-ALL-2162212 CHEBI:64182 chebi:64182	3-demethylubiquinol-10 2-decaprenyl-5-hydroxy-6-methoxy-3-methyl-1,4-benzoquinol 2-decaprenyl-5-hydroxy-6-methoxy-3-methylhydroquinone 5-[(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]-3-methoxy-6-methylbenzene-1,2,4-triol
bigg.metabolite:M00770 biggM:M00770	3-Demethylubiquinol-10
metacyc.compound:CPD-9873 metacycM:CPD-9873 seed.compound:cpd25888 seedM:cpd25888	3-demethylubiquinol-10
hmdb:HMDB0062350	3-demethylubiquinol-10 2-Decaprenyl-5-hydroxy-6-methoxy-3-methyl-1,4-benzoquinol 2-Decaprenyl-5-hydroxy-6-methoxy-3-methylhydroquinone 5-[(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]-3-methoxy-6-methylbenzene-1,2,4-triol
hmdb:HMDB62350 biggM:M_M00770 seedM:M_cpd25888	secondary/obsolete/fantasy identifier