The Drug Ontology

Last uploaded: March 3, 2024
Preferred Name

Benzoin

Synonyms

2-hydroxy-1,2-diphenylethanone

Benzoin

benzoin

2-Hydroxy-2-phenylacetophenone

PhCH(OH)COPh

Benzoylphenylcarbinol

Phenyl-alpha-hydroxybenzyl ketone

PhCOCH(OH)Ph

Hydroxy-2-phenyl acetophenone

2-Hydroxy-1,2-diphenylethanone

alpha-hydroxy-alpha-phenylacetophenone

Phenylbenzoyl carbinol

alpha-Hydroxy-alpha-phenylacetophenone

phenyl-alpha-hydroxybenzyl ketone

alpha-Hydroxybenzyl phenyl ketone

Definitions

A ketone that consists of acetophenone bearing hydroxy and phenyl substituents at the alpha-position. The parent of the class of benzoins.

ID

http://purl.obolibrary.org/obo/CHEBI_17682

charge

0

database_cross_reference

Beilstein:391839

CAS:119-53-9

PMID:16107154

Reaxys:391839

PMID:17399985

Drug_Central:4663

KEGG:C01408

HMDB:HMDB0032039

PMID:15828829

Wikipedia:Benzoin

definition

A ketone that consists of acetophenone bearing hydroxy and phenyl substituents at the alpha-position. The parent of the class of benzoins.

formula

C14H12O2

has role

http://purl.obolibrary.org/obo/CHEBI_78444

has_alternative_id

CHEBI:22724

CHEBI:13880

CHEBI:3031

has_exact_synonym

2-hydroxy-1,2-diphenylethanone

Benzoin

benzoin

has_obo_namespace

chebi_ontology

has_related_synonym

2-Hydroxy-2-phenylacetophenone

PhCH(OH)COPh

Benzoylphenylcarbinol

Phenyl-alpha-hydroxybenzyl ketone

PhCOCH(OH)Ph

Hydroxy-2-phenyl acetophenone

2-Hydroxy-1,2-diphenylethanone

alpha-hydroxy-alpha-phenylacetophenone

Phenylbenzoyl carbinol

alpha-Hydroxy-alpha-phenylacetophenone

2-hydroxy-1,2-diphenylethanone

phenyl-alpha-hydroxybenzyl ketone

alpha-Hydroxybenzyl phenyl ketone

has_RxCUI

1406

id

CHEBI:17682

in_subset

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

inchi

InChI=1S/C14H12O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13,15H

inchikey

ISAOCJYIOMOJEB-UHFFFAOYSA-N

label

Benzoin

benzoin

mass

212.24388

monoisotopicmass

212.08373

notation

CHEBI:17682

prefLabel

Benzoin

smiles

OC(C(=O)c1ccccc1)c1ccccc1

subClassOf

http://purl.obolibrary.org/obo/CHEBI_2468

http://purl.obolibrary.org/obo/CHEBI_51586

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Delete Mapping To Ontology Source
http://purl.obolibrary.org/obo/CHEBI_17682 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_17682 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_17682 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_17682 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_17682 GO-PLUS SAME_URI
http://sbmi.uth.tmc.edu/ontology/ochv#1796 OCHV LOOM
https://go.drugbank.com/drugs/DB14020 MDM LOOM
http://purl.obolibrary.org/obo/MESH_D001573 BERO LOOM
http://purl.bioontology.org/ontology/MESH/D001573 MESH LOOM
http://purl.obolibrary.org/obo/CHEBI_17682 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_17682 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_17682 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_17682 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_17682 GO-PLUS LOOM
http://www.co-ode.org/ontologies/galen#Benzoin GALEN LOOM
http://purl.jp/bio/4/id/200906043531938647 IOBC LOOM
http://purl.obolibrary.org/obo/OMIT_0002938 OMIT LOOM
http://stirdf.jst.go.jp/id/200907057428870168 IOBC LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C77026 NCIT LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0005070 OCHV LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D001573 RH-MESH LOOM
http://id.nlm.nih.gov/mesh/D001573 MDM LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000147353 NDFRT LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/391828004 SNOMEDCT LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.522.120.100 RH-MESH LOOM
http://www.phoc.org.cn/pmo/class/PMO_00017129 PMAPP-PMO LOOM
http://purl.bioontology.org/ontology/VANDF/4019093 VANDF LOOM
http://purl.obolibrary.org/obo/NCIT_C77026 BERO LOOM