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3-demethylubiquinol-8

Properties

Image

Occurences in reactions

MNX_ID

MNXM1104278

	#reac
in my sandbox	0
in MNXref (generic)	12
in models (compartimentalized)	9

formula

C₄₈H₇₄O₄

charge

mass

714.55871

reference

chebi:61705

InChIKey

QURLIMHPCRKMJP-WDXILIIOSA-N

InChI

InChI=1S/C48H74O4/c1-35(2)19-12-20-36(3)21-13-22-37(4)23-14-24-38(5)25-15-26-39(6)27-16-28-40(7)29-17-30-41(8)31-18-32-42(9)33-34-44-43(10)45(49)47(51)48(52-11)46(44)50/h19,21,23,25,27,29,31,33,49-51H,12-18,20,22,24,26,28,30,32,34H2,1-11H3/b36-21+,37-23+,38-25+,39-27+,40-29+,41-31+,42-33+

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)CCC=C(C)C)c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:61705 chebi:61705	3-demethylubiquinol-8 2-octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol 3-methoxy-6-methyl-5-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]benzene-1,2,4-triol OMHMB
bigg.metabolite:2omhmbl biggM:2omhmbl	2-Octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol
seed.compound:cpd03449 seedM:cpd03449	2-Octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinone 2-Octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol 2-octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol 2-octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinone 3-demethylubiquinol-8 OCTAPRENYL-METHYL-OH-METHOXY-BENZQ OMHMB
metacyc.compound:OCTAPRENYL-METHYL-OH-METHOXY-BENZQ metacycM:OCTAPRENYL-METHYL-OH-METHOXY-BENZQ	3-demethylubiquinol-8 2-octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol 2-octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinone OMHMB
biggM:M_2omhmbl seedM:M_cpd03449	secondary/obsolete/fantasy identifier