CHEBI:34283 - oxybenzone

ChEBI IDCHEBI:34283
ChEBI Nameoxybenzone
Stars
DefinitionA hydroxybenzophenone that is benzophenone which is substituted at the 2- and 4-positions of one of the benzene rings by hydroxy and methoxy groups respectively.
Secondary ChEBI IDCHEBI:569732
Last Modified13 March 2017
DownloadsMolfile
FormulaC14H12O3
Net Charge0
Average Mass228.247
Monoisotopic Mass228.07864
SMILESCOc1ccc(C(=O)c2ccccc2)c(O)c1
InChIInChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3
InChIKeyDXGLGDHPHMLXJC-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Roles:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
ultraviolet filter  A photochemical role realized in the absorption of ultraviolet light, for example to protect skin cells from damage.
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Applications:
dermatologic drug  A drug used to treat or prevent skin disorders or for the routine care of skin.
protective agent  Synthetic or natural substance which is given to prevent a disease or disorder or are used in the process of treating a disease or injury due to a poisonous agent.
ChEBI Ontology
Outgoing Relation(s)
oxybenzone (CHEBI:34283) has role dermatologic drug (CHEBI:50177)
oxybenzone (CHEBI:34283) has role environmental contaminant (CHEBI:78298)
oxybenzone (CHEBI:34283) has role protective agent (CHEBI:50267)
oxybenzone (CHEBI:34283) has role ultraviolet filter (CHEBI:73335)
oxybenzone (CHEBI:34283) has role xenobiotic (CHEBI:35703)
oxybenzone (CHEBI:34283) is a hydroxybenzophenone (CHEBI:24677)
oxybenzone (CHEBI:34283) is a monomethoxybenzene (CHEBI:25235)
IUPAC Name 
(2-hydroxy-4-methoxyphenyl)(phenyl)methanone
INNs  Source
oxibenzonaChemIDplus
oxybenzonumChemIDplus
oxybenzoneChemIDplus
Synonyms  Source
2-Hydroxy-4-methoxybenzophenoneKEGG COMPOUND
Benzophenone-3ChemIDplus
2-Benzoyl-5-methoxyphenolDrugBank
4-Methoxy-2-hydroxybenzophenoneDrugBank
Manual XrefsDatabases
C14285KEGG COMPOUND
US2773903Patent
US2861104Patent
US2861105Patent
US3073866Patent
D05309KEGG DRUG
DB01428DrugBank
OxybenzoneWikipedia
HMDB0015497HMDB
LSM-3309LINCS
3412DrugCentral
Registry NumbersSources
Reaxys:1913145Reaxys
CAS:131-57-7KEGG COMPOUND
CAS:131-57-7NIST Chemistry WebBook
CAS:131-57-7ChemIDplus
Citations