CHEBI:28433 - phyllohydroquinone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name phyllohydroquinone
ChEBI ID CHEBI:28433
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:27303, CHEBI:10011
Supplier Information
Download Molfile XML SDF
Formula C31H48O2
Net Charge 0
Average Mass 452.71162
Monoisotopic Mass 452.365
InChI InChI=1S/C31H48O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24,32-33H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1
InChIKey BUFJIHPUGZHTHL-NKFFZRIASA-N
SMILES CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC\C(C)=C\Cc1c(C)c(O)c2ccccc2c1O
ChEBI Ontology
Outgoing phyllohydroquinone (CHEBI:28433) is a naphthohydroquinone (CHEBI:51475)
phyllohydroquinone (CHEBI:28433) is a polyprenylhydroquinone (CHEBI:26253)
IUPAC Name
2-methyl-3-[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]naphthalene-1,4-diol
Synonyms Sources
phylloquinol UniProt
Phytonadiol KEGG COMPOUND
Phytonadiol ChemIDplus
Vitamin K hydroquinone KEGG COMPOUND
Vitamin K1 hydroquinone KEGG COMPOUND
vitamin K1 hydroquinone ChemIDplus
Database Link Database
C03313 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
3168075 Beilstein Registry Number Beilstein
572-96-3 CAS Registry Number KEGG COMPOUND
572-96-3 CAS Registry Number ChemIDplus
Last Modified
13 October 2016