CHEBI:4414 - deoxylapachol

ChEBI IDCHEBI:4414
ChEBI Namedeoxylapachol
Stars
DefinitionA member of the class of 1,4-naphthoquinones that is 1,4-naphthoquinone substituted by a 3-methylbut-2-en-1-yl group at position 2.
Last Modified27 September 2024
DownloadsMolfile
FormulaC15H14O2
Net Charge0
Average Mass226.275
Monoisotopic Mass226.09938
SMILESCC(C)=CCC1=CC(=O)c2ccccc2C1=O
InChIInChI=1S/C15H14O2/c1-10(2)7-8-11-9-14(16)12-5-3-4-6-13(12)15(11)17/h3-7,9H,8H2,1-2H3
InChIKeyOSDFYZPKJKRCRR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Landsburgia quercifolia (ncbitaxon:590122) - PubMed (1791483)
Tectona grandis (ncbitaxon:41396) - PubMed (6521757)
Roles Classification
Biological Roles:
marine metabolite  Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
algal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in algae including unicellular organisms like chlorella and diatoms to multicellular organisms like giant kelps and brown algae.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
deoxylapachol (CHEBI:4414) has role algal metabolite (CHEBI:84735)
deoxylapachol (CHEBI:4414) has role antifungal agent (CHEBI:35718)
deoxylapachol (CHEBI:4414) has role antineoplastic agent (CHEBI:35610)
deoxylapachol (CHEBI:4414) has role marine metabolite (CHEBI:76507)
deoxylapachol (CHEBI:4414) has role plant metabolite (CHEBI:76924)
deoxylapachol (CHEBI:4414) is a 1,4-naphthoquinones (CHEBI:132142)
deoxylapachol (CHEBI:4414) is a olefinic compound (CHEBI:78840)
IUPAC Name 
2-(3-methylbut-2-en-1-yl)naphthalene-1,4-dione
Synonyms  Source
2-(3-methyl-2-buten-1-yl)-1,4-naphthalenedioneChEBI
2-(3-methyl-2-butenyl)-1,4-naphthoquinoneChEBI
2-(3-methyl-2-butenyl)naphthalene-1,4-dioneChEBI
desoxylapacholChEBI
UniProt Name  Source
3-prenyl-1,4-naphthoquinoneUniProt
Manual XrefsDatabases
C00002813KNApSAcK
C10325KEGG COMPOUND
Registry NumbersSources
CAS:3568-90-9KEGG COMPOUND
Citations