The Drug Ontology

Last uploaded: November 15, 2024
Preferred Name

alprazolam
Synonyms

8-Chloro-1-methyl-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine

Xanax

8-chloro-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Alprazolam

Definitions

A member of the class of triazolobenzodiazepines that is 4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine carrying methyl, phenyl and chloro substituents at positions 1, 6 and 8 respectively. Alprazolam is only found in individuals that have taken this drug.

ID

http://purl.obolibrary.org/obo/CHEBI_2611

alternative label

8-Chloro-1-methyl-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine

Xanax

8-chloro-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Alprazolam

charge

0

database_cross_reference

PMID:25427652

KEGG:C06817

PMID:10350361

PMID:12035937

PMID:24629629

PMID:17631455

PMID:11824768

KEGG:D00225

Drug_Central:136

PMID:24464531

LINCS:LSM-5460

Wikipedia:Alprazolam

DrugBank:DB00404

PMID:25032127

HMDB:HMDB0014548

PMID:24977401

PMID:16572266

PMID:16139113

PMID:11304902

PMID:10443648

PMID:25139178

PMID:15647704

CAS:28981-97-7

PMID:10963939

PMID:9050091

PMID:25199955

PMID:24840273

PMID:10631626

Reaxys:1223125

PMID:25300043

PMID:25620535

PMID:25581490

PMID:15725773

PMID:10997633

PMID:16103667

PMID:24361783

PMID:7907366

PMID:15830221

VSDB:2960

definition

A member of the class of triazolobenzodiazepines that is 4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine carrying methyl, phenyl and chloro substituents at positions 1, 6 and 8 respectively. Alprazolam is only found in individuals that have taken this drug.

formula

C17H13ClN4

has role

http://purl.obolibrary.org/obo/CHEBI_51371

http://purl.obolibrary.org/obo/CHEBI_35474

http://purl.obolibrary.org/obo/CHEBI_35703

http://purl.obolibrary.org/obo/CHEBI_35717

http://purl.obolibrary.org/obo/CHEBI_35623

http://purl.obolibrary.org/obo/CHEBI_51373

has_exact_synonym

8-chloro-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Alprazolam

has_obo_namespace

chebi_ontology

has_related_synonym

8-Chloro-1-methyl-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine

Xanax

has_RxCUI

596

id

CHEBI:2611

in_subset

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

inchi

InChI=1S/C17H13ClN4/c1-11-20-21-16-10-19-17(12-5-3-2-4-6-12)14-9-13(18)7-8-15(14)22(11)16/h2-9H,10H2,1H3

inchikey

VREFGVBLTWBCJP-UHFFFAOYSA-N

is_bearer_of

http://purl.obolibrary.org/obo/DRON_00000072

label

alprazolam

mass

308.76478

monoisotopicmass

308.08287

notation

CHEBI:2611

prefLabel

alprazolam

smiles

Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12

subClassOf

http://purl.obolibrary.org/obo/CHEBI_36683

http://purl.obolibrary.org/obo/CHEBI_35501

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Mapping To Ontology Source
http://purl.obolibrary.org/obo/CHEBI_2611 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2611 FIDEO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2611 DINTO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2611 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2611 DDSS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2611 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2611 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_2611 NIFSTD SAME_URI
http://purl.bioontology.org/ontology/LNC/LA28623-9 LOINC LOOM
http://purl.obolibrary.org/obo/NCIT_C227 BERO LOOM
http://purl.bioontology.org/ontology/RXNORM/596 RXNORM LOOM
http://www.semanticweb.org/ftuha/ontologies/2021/5/FRMO-01untitled-ontology-175/Alprazolam FRMO LOOM
http://purl.bioontology.org/ontology/LNC/LP14981-2 LOINC LOOM
http://scai.fraunhofer.de/MSOntology#Alprazolam MSO LOOM
http://purl.bioontology.org/ontology/CSP/0314-3750 CRISP LOOM
http://purl.bioontology.org/ontology/ATC/N05BA12 ATC LOOM
http://purl.obolibrary.org/obo/OMIT_0001944 OMIT LOOM
http://purl.bioontology.org/ontology/RCD/d22.. RCD LOOM
http://www.drugbank.ca/drugs/DB00404 FTC LOOM
http://www.co-ode.org/ontologies/galen#Alprazolam GALEN LOOM
http://purl.bioontology.org/ontology/LNC/MTHU066194 LOINC LOOM
http://purl.jp/bio/4/id/200906069297504610 IOBC LOOM
http://stirdf.jst.go.jp/id/200907051047455611 IOBC LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/386983007 SNOMEDCT LOOM
http://purl.bioontology.org/ontology/MESH/D000525 MESH LOOM
http://purl.bioontology.org/ontology/NDDF/001464 NDDF LOOM
http://www.phoc.org.cn/pmo/class/PMO_00017572 PMAPP-PMO LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000146413 NDFRT LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#947 OCHV LOOM
http://purl.bioontology.org/ontology/VANDF/4018074 VANDF LOOM
http://purl.bioontology.org/ontology/PDQ/CDR0000039659 PDQ LOOM
http://purl.obolibrary.org/obo/CHEBI_2611 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_2611 FIDEO LOOM
http://purl.obolibrary.org/obo/CHEBI_2611 DINTO LOOM
http://purl.obolibrary.org/obo/CHEBI_2611 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_2611 DDSS LOOM
http://purl.obolibrary.org/obo/CHEBI_2611 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_2611 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_2611 NIFSTD LOOM
http://purl.bioontology.org/ontology/LNC/MTHU060426 LOINC LOOM
http://www.semanticweb.org/administrator/ontologies/2022/0/untitled-ontology-34#OWLClass309ffa9d_b757_46ec_9f72_f92e4c6c7bfc WWECA LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D000525 RH-MESH LOOM
http://ontology.apa.org/apaonto/termsonlyOUT%20(5).owl#Alprazolam APAONTO LOOM
http://www.semanticweb.org/administrator/ontologies/2022/0/untitled-ontology-34#OWLClassa9fc2b85_aaf1_48e7_bc93_32e57761892b WWECA LOOM
http://purl.bioontology.org/ontology/SNMI/C-64520 SNMI LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.438.079.080.030 RH-MESH LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C227 NCIT LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0002333 OCHV LOOM
https://go.drugbank.com/drugs/DB00404 MDM LOOM
http://purl.obolibrary.org/obo/MESH_D000525 BERO LOOM
https://bioportal.bioontology.org/ontologies/STMSO#Alprazolam STMSO LOOM
http://www.limics.fr/ontologies/ontoparonmed#Alprazolam ONTOPARON LOOM