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CHEBI:87844 - 2-phytyl-1,4-dihydroxynaphthalene

ChEBI IDCHEBI:87844
ChEBI Name2-phytyl-1,4-dihydroxynaphthalene
Stars
DefinitionA member of the class of naphthalenediols that is naphthalene-1,4-diol substituted at position 2 by a phytyl group.
Last Modified31 January 2017
SubmitterAnne Morgat
DownloadsMolfile
FormulaC30H46O2
Net Charge0
Average Mass438.696
Monoisotopic Mass438.34978
SMILESC/C(=C\Cc1cc(O)c2ccccc2c1O)CCC[C@H](C)CCC[C@H](C)CCCC(C)C
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
InChIKeyAEFNZGGBWOQYID-KQPZCCJBSA-N
ChEBI Ontology
Outgoing Relation(s)
2-phytyl-1,4-dihydroxynaphthalene (CHEBI:87844) has functional parent naphthalene-1,4-diol (CHEBI:34063)
2-phytyl-1,4-dihydroxynaphthalene (CHEBI:87844) is a naphthalenediols (CHEBI:23783)
2-phytyl-1,4-dihydroxynaphthalene (CHEBI:87844) is a naphthohydroquinone (CHEBI:51475)
2-phytyl-1,4-dihydroxynaphthalene (CHEBI:87844) is a olefinic compound (CHEBI:78840)
IUPAC Name 
2-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-diol
Synonyms  Source
demethylphylloquinolMetaCyc
2-phytylnaphthalene-1,4-diolChEBI
UniProt Name  Source
demethylphylloquinolUniProt
Manual XrefsDatabases
CPD-12830MetaCyc