The Prescription of Drugs Ontology

Last uploaded: September 4, 2020
Preferred Name

dibutyl phthalate

Synonyms

dibutyl benzene-1,2-dicarboxylate

Dibutyl phthalate

Dibutyl-o-phthalate

Phthalic acid dibutyl ester

Dibutyl o-phthalate

1,2-Benzenedicarboxylic acid dibutyl ester

Phthalic acid di-n-butyl ester

n-Butyl phthalate

Benzenedicarboxylic acid dibutyl ester

Dibutyl 1,2-benzenedicarboxylate

Butyl phthalate

Benzene-o-dicarboxylic acid di-n-butyl ester

o-Benzenedicarboxylic acid dibutyl ester

Di-n-butyl phthalate

DBP

Definitions

A phthalate ester that is the diester obtained by the formal condensation of the carboxy groups of phthalic acid with two molecules of butan-1-ol. Although used extensively as a plasticiser, it is a ubiquitous environmental contaminant that poses a risk to humans.

ID

http://purl.obolibrary.org/obo/CHEBI_34687

charge

0

database_cross_reference

PMID:24616073

PMID:28753974

CAS:84-74-2

KEGG:C14214

PMID:28823096

PMID:16232742

Beilstein:1914064

Drug_Central:4414

PMID:11133400

PMID:28486587

PMID:28566680

HMDB:HMDB0033244

PMID:24468924

PMID:26730679

PMID:27655612

PMID:19840837

PMID:28580302

PMID:28363850

PMID:28822891

PMID:28102498

Reaxys:1914064

PMID:24213843

Wikipedia:Dibutyl_phthalate

Gmelin:262569

PPDB:2924

formula

C16H22O4

has functional parent

http://purl.obolibrary.org/obo/CHEBI_28885

has role

http://purl.obolibrary.org/obo/CHEBI_50905

http://purl.obolibrary.org/obo/CHEBI_79056

http://purl.obolibrary.org/obo/CHEBI_25212

http://purl.obolibrary.org/obo/CHEBI_67239

http://purl.obolibrary.org/obo/CHEBI_78298

has_alternative_id

CHEBI:535597

has_exact_synonym

dibutyl benzene-1,2-dicarboxylate

Dibutyl phthalate

has_obo_namespace

chebi_ontology

has_related_synonym

Dibutyl-o-phthalate

Phthalic acid dibutyl ester

Dibutyl o-phthalate

1,2-Benzenedicarboxylic acid dibutyl ester

Phthalic acid di-n-butyl ester

n-Butyl phthalate

Benzenedicarboxylic acid dibutyl ester

Dibutyl 1,2-benzenedicarboxylate

Butyl phthalate

Benzene-o-dicarboxylic acid di-n-butyl ester

o-Benzenedicarboxylic acid dibutyl ester

Di-n-butyl phthalate

DBP

has_RxCUI

1362873

id

CHEBI:34687

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3

inchikey

DOIRQSBPFJWKBE-UHFFFAOYSA-N

label

dibutyl phthalate

Dibutyl Phthalate

mass

278.34350

monoisotopicmass

278.15181

notation

CHEBI:34687

prefixIRI

CHEBI:34687

prefLabel

dibutyl phthalate

smiles

CCCCOC(=O)c1ccccc1C(=O)OCCCC

textual definition

A phthalate ester that is the diester obtained by the formal condensation of the carboxy groups of phthalic acid with two molecules of butan-1-ol. Although used extensively as a plasticiser, it is a ubiquitous environmental contaminant that poses a risk to humans.

subClassOf

http://purl.obolibrary.org/obo/CHEBI_51307

http://purl.obolibrary.org/obo/CHEBI_35484

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http://purl.obolibrary.org/obo/CHEBI_34687 EFO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_34687 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_34687 GO-PLUS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_34687 OCMR SAME_URI
http://purl.obolibrary.org/obo/CHEBI_34687 GO-PLUS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_34687 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_34687 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_34687 DRON SAME_URI
http://purl.obolibrary.org/obo/XCO_0000513 XCO LOOM
http://purl.obolibrary.org/obo/CHEBI_34687 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_34687 GO-PLUS LOOM
http://purl.obolibrary.org/obo/CHEBI_34687 EFO LOOM
http://purl.bioontology.org/ontology/ATC/P03BX03 ATC LOOM
http://www.phoc.org.cn/pmo/class/PMO_00016564 PMAPP-PMO LOOM
http://purl.bioontology.org/ontology/MESH/D003993 MESH LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#3882 OCHV LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C76745 NCIT LOOM
http://purl.bioontology.org/ontology/NDDF/006320 NDDF LOOM
http://purl.bioontology.org/ontology/RXNORM/1362873 RXNORM LOOM
http://purl.bioontology.org/ontology/SNMI/C-23402 SNMI LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.241.223.805.225 RH-MESH LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D003993 RH-MESH LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/4353000 SNOMEDCT LOOM
http://id.nlm.nih.gov/mesh/D003993 MDM LOOM
https://go.drugbank.com/drugs/DB13716 MDM LOOM
http://purl.obolibrary.org/obo/OMIT_0005264 OMIT LOOM
http://purl.obolibrary.org/obo/NCIT_C76745 BERO LOOM
http://purl.obolibrary.org/obo/MESH_D003993 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_34687 OCMR LOOM
http://purl.obolibrary.org/obo/CHEBI_34687 GO-PLUS LOOM
http://purl.obolibrary.org/obo/CHEBI_34687 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_34687 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_34687 DRON LOOM