Search MNXref
 Feedback

2,3-dimethyl-6-phytylbenzene-1,4-diol

PropertiesImage
MNX_IDMNXM4266 Image of MNXM4266
referencechebi:75921
formulaC28H48O2
global charge0
mol weight416.69
InChIKeySUFZKUBNOVDJRR-WGEODTKDSA-N
InChIInChI=1S/C28H48O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-16-23(5)17-18-26-19-27(29)24(6)25(7)28(26)30/h17,19-22,29-30H,8-16,18H2,1-7H3/b23-17+/t21-,22-/m1/s1
SMILESCC1=C(O)C=C(C/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(O)=C1C
MNX internals
InChI (mnx)InChI=1/C28H48O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-16-23(5)17-18-26-19-27(29)24(6)25(7)28(26)30/h17,19-22,29-30H,8-16,18H2,1-7H3/b23-17+/t21-,22-/m1/s1 Image of MNXM4266
SMILES (mnx)[CH3:1][CH:20]([CH3:2])[CH2:11][CH2:8][CH2:12][C@@H:21]([CH3:3])[CH2:13][CH2:9][CH2:14][C@@H:22]([CH3:4])[CH2:15][CH2:10][CH2:16]/[C:23]([CH3:5])=[CH:17]/[CH2:18][C:26]1=[CH:19][C:27]([OH:29])=[C:24]([CH3:6])[C:25]([CH3:7])=[C:28]1[OH:30]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)12
in models (compartimentalized) 6
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:75921
chebi:75921
SUFZKUBNOVDJRR-WGEODTKDSA-N 		2,3-dimethyl-6-phytylbenzene-1,4-diol
(R,R)-2,3-dimethyl-6-phytylhydroquinone
2,3-dimethyl-6-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]benzene-1,4-diol
phytylplastoquinol

bigg.metabolite:23dmphol
biggM:23dmphol 		2,3-Dimethyl-5-phytylquinol

kegg.compound:C15883
keggC:C15883
SUFZKUBNOVDJRR-WGEODTKDSA-N 		2,3-Dimethyl-5-phytylquinol
2,3-Dimethyl-5-phytyl-1,4-hydroquinone
2,3-Dimethyl-6-phytylbenzene-1,4-diol

seed.compound:cpd14614
seedM:cpd14614
SUFZKUBNOVDJRR-WGEODTKDSA-N 		2,3-Dimethyl-5-phytylquinol
2,3-Dimethyl-5-phytyl-1,4-hydroquinone
2,3-Dimethyl-6-phytylbenzene-1,4-diol
2,3-dimethyl-6-phytyl-1,4-benzoquinol

metacyc.compound:DMPBQ
metacycM:DMPBQ
SUFZKUBNOVDJRR-WGEODTKDSA-N 		2,3-dimethyl-6-phytyl-1,4-benzoquinol
hmdb:HMDB0302992
SUFZKUBNOVDJRR-WGEODTKDSA-N 		Phytylplastoquinol
2,3-Dimethyl-6-phytylbenzene-1,4-diol
2,3-dimethyl-5-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]benzene-1,4-diol
2,3-dimethyl-5-phytylquinol

biggM:M_23dmphol
keggC:M_C15883
seedM:M_cpd14614 		secondary/obsolete/fantasy identifier