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ubiquinol-9

MNXM7857 is deprecated and replaced by MNXM1094084

Properties

Image

Occurences in reactions

MNX_ID

MNXM1094084

	#reac
in my sandbox	0
in MNXref (generic)	39
in models (compartimentalized)	0

formula

C₅₄H₈₄O₄

charge

mass

796.63696

reference

chebi:84424

InChIKey

NPCOQXAVBJJZBQ-WJNLUYJISA-N

InChI

InChI=1S/C54H84O4/c1-40(2)22-14-23-41(3)24-15-25-42(4)26-16-27-43(5)28-17-29-44(6)30-18-31-45(7)32-19-33-46(8)34-20-35-47(9)36-21-37-48(10)38-39-50-49(11)51(55)53(57-12)54(58-13)52(50)56/h22,24,26,28,30,32,34,36,38,55-56H,14-21,23,25,27,29,31,33,35,37,39H2,1-13H3/b41-24+,42-26+,43-28+,44-30+,45-32+,46-34+,47-36+,48-38+

SMILES

COc1c(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)CCC=C(C)C)c(O)c1OC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:84424 chebi:84424	ubiquinol-9 2,3-dimethoxy-5-methyl-6-[(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-nonaen-1-yl]benzene-1,4-diol
bigg.metabolite:q9h2 biggM:q9h2	Ubiquinol-9
seed.compound:cpd25914 seedM:cpd25914	ubiquinol(9) ubiquinol-9
metacyc.compound:CPD-9957 metacycM:CPD-9957	ubiquinol-9 ubiquinol(9)
biggM:M_q9h2 seedM:M_cpd25914	secondary/obsolete/fantasy identifier