Feedback

3-demethylubiquinol-7

Properties

Image

Occurences in reactions

MNX_ID

MNXM9999

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

formula

C₄₃H₆₆O₄

charge

mass

646.49611

reference

chebi:84431

InChIKey

OHBHBMXNJCUMCR-DKCCAHEHSA-N

InChI

InChI=1S/C43H66O4/c1-31(2)17-11-18-32(3)19-12-20-33(4)21-13-22-34(5)23-14-24-35(6)25-15-26-36(7)27-16-28-37(8)29-30-39-38(9)40(44)42(46)43(47-10)41(39)45/h17,19,21,23,25,27,29,44-46H,11-16,18,20,22,24,26,28,30H2,1-10H3/b32-19+,33-21+,34-23+,35-25+,36-27+,37-29+

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)CCC=C(C)C)c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:84431 chebi:84431	3-demethylubiquinol-7 2-heptaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol 5-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]-3-methoxy-6-methylbenzene-1,2,4-triol
seed.compound:cpd25878 seedM:cpd25878	2-heptaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol 3-demethylubiquinol-7
metacyc.compound:CPD-9861 metacycM:CPD-9861	3-demethylubiquinol-7 2-heptaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol
seedM:M_cpd25878	secondary/obsolete/fantasy identifier