The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

artesunate
Synonyms

artesunate

AS

artesunatum

dihydroqinghasu hemsuccinate

C19H28O8

artesunic acid

4-oxo-4-{[(3R,5aS,6R,8aS,9R,10S,12R,12aR)-3,6,9-trimethyldecahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepin-10-yl]oxy}butanoic acid

butanedioic acid, 1-[(3R,5aS,6R,8aS,9R,10S,12R,12aR)-decahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano[4,3-j]-1,2-benzodioxepin-10-yl] ester

artesunato

ID

http://purl.obolibrary.org/obo/CHEBI_63918

Definition

An artemisinin derivative that is the hemisuccinate ester of the lactol resulting from the reduction of the lactone carbonyl group of artemisinin. It is used, generally as the sodium salt, for the treatment of malaria.

has role

http://purl.obolibrary.org/obo/CHEBI_38068

InChI

InChI=1S/C19H28O8/c1-10-4-5-13-11(2)16(23-15(22)7-6-14(20)21)24-17-19(13)12(10)8-9-18(3,25-17)26-27-19/h10-13,16-17H,4-9H2,1-3H3,(H,20,21)/t10-,11-,12+,13+,16-,17-,18-,19-/m1/s1

InChIKey

InChIKey=FIHJKUPKCHIPAT-AHIGJZGOSA-N

label

artesunate

prefixIRI

obo2:CHEBI_63918

prefLabel

artesunate

SMILES

[H][C@@]12CC[C@@]3(C)OO[C@@]11[C@@]([H])(CC[C@H]2C)[C@@H](C)[C@H](OC(=O)CCC(O)=O)O[C@]1([H])O3

Synonym

artesunate

AS

artesunatum

dihydroqinghasu hemsuccinate

C19H28O8

artesunic acid

4-oxo-4-{[(3R,5aS,6R,8aS,9R,10S,12R,12aR)-3,6,9-trimethyldecahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepin-10-yl]oxy}butanoic acid

butanedioic acid, 1-[(3R,5aS,6R,8aS,9R,10S,12R,12aR)-decahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano[4,3-j]-1,2-benzodioxepin-10-yl] ester

artesunato

xref

CASRN:182824-33-5

NIST Chemistry WebBook:88495-63-0

KEGG DRUG:D02482

Reaxys:6003212

CASRN:88495-63-0

Wikipedia:Artesunate

subClassOf

http://purl.obolibrary.org/obo/dinto_000055

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Mapping To Ontology Source
http://purl.obolibrary.org/obo/CHEBI_63918 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_63918 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_63918 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_63918 CCONT SAME_URI
http://purl.obolibrary.org/obo/CHEBI_63918 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_63918 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_63918 DDSS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_63918 EFO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_63918 DRON LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000171767 NDFRT LOOM
http://purl.bioontology.org/ontology/VANDF/4025235 VANDF LOOM
http://purl.bioontology.org/ontology/RXNORM/18346 RXNORM LOOM
http://purl.bioontology.org/ontology/MESH/D000077332 MESH LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C039726 RH-MESH LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0052432 OCHV LOOM
https://go.drugbank.com/drugs/DB09274 MDM LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/432410005 SNOMEDCT LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C73005 NCIT LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#13525 OCHV LOOM
http://www.phoc.org.cn/pmo/class/PMO_00026683 PMAPP-PMO LOOM
http://purl.bioontology.org/ontology/PDQ/CDR0000617258 PDQ LOOM
http://purl.obolibrary.org/obo/SCDO_0000073 SCDO LOOM
http://purl.bioontology.org/ontology/ATC/P01BE03 ATC LOOM
http://purl.obolibrary.org/obo/NCIT_C73005 BERO LOOM
http://purl.obolibrary.org/obo/IDOMAL_0000246 IDOMAL LOOM
http://purl.obolibrary.org/obo/CHEBI_63918 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_63918 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_63918 CCONT LOOM
http://purl.obolibrary.org/obo/CHEBI_63918 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_63918 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_63918 DDSS LOOM
http://purl.obolibrary.org/obo/CHEBI_63918 EFO LOOM
http://purl.bioontology.org/ontology/NDDF/009953 NDDF LOOM