Search MNXref
 Feedback

demethylphylloquinol

PropertiesImage
MNX_IDMNXM11334 Image of MNXM11334
referencechebi:87844
formulaC30H46O2
global charge0
mol weight438.696
InChIKeyAEFNZGGBWOQYID-KQPZCCJBSA-N
InChIInChI=1S/C30H46O2/c1-22(2)11-8-12-23(3)13-9-14-24(4)15-10-16-25(5)19-20-26-21-29(31)27-17-6-7-18-28(27)30(26)32/h6-7,17-19,21-24,31-32H,8-16,20H2,1-5H3/b25-19+/t23-,24-/m1/s1
SMILESC/C(=C\CC1=CC(O)=C2C=CC=CC2=C1O)CCC[C@H](C)CCC[C@H](C)CCCC(C)C
MNX internals
InChI (mnx)InChI=1/C30H46O2/c1-22(2)11-8-12-23(3)13-9-14-24(4)15-10-16-25(5)19-20-26-21-29(31)27-17-6-7-18-28(27)30(26)32/h6-7,17-19,21-24,31-32H,8-16,20H2,1-5H3/b25-19+/t23-,24-/m1/s1 Image of MNXM11334
SMILES (mnx)[CH3:1][CH:22]([CH3:2])[CH2:11][CH2:8][CH2:12][C@@H:23]([CH3:3])[CH2:13][CH2:9][CH2:14][C@@H:24]([CH3:4])[CH2:15][CH2:10][CH2:16]/[C:25]([CH3:5])=[CH:19]/[CH2:20][C:26]1=[C:30]([OH:32])[C:28]2=[CH:18][CH:7]=[CH:6][CH:17]=[C:27]2[C:29]([OH:31])=[CH:21]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)12
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:87844
chebi:87844
AEFNZGGBWOQYID-KQPZCCJBSA-N 		demethylphylloquinol
2-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-diol
2-phytyl-1,4-dihydroxynaphthalene
2-phytylnaphthalene-1,4-diol

seed.compound:cpd23602
seedM:cpd23602
AEFNZGGBWOQYID-KQPZCCJBSA-N 		3-phytyl-1,4-naphtoquinol
2-phytyl-1,4-naphthoquinol
demethylphylloquinol

kegg.compound:C21084
keggC:C21084
AEFNZGGBWOQYID-NCELDCMTSA-N 		Demethylphylloquinol

metacyc.compound:CPD-12830
metacycM:CPD-12830
AEFNZGGBWOQYID-KQPZCCJBSA-N 		demethylphylloquinol
2-phytyl-1,4-naphthoquinol

keggC:M_C21084
seedM:M_cpd23602 		secondary/obsolete/fantasy identifier