loading...| Preferred Name |
artesunate |
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| 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 |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_63918 |
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| 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. |
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| has role | ||
| 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 |
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| InChIKey |
InChIKey=FIHJKUPKCHIPAT-AHIGJZGOSA-N |
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| label |
artesunate |
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| prefixIRI |
obo2:CHEBI_63918 |
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| prefLabel |
artesunate |
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| 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 |
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| 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 |
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| xref |
CASRN:182824-33-5 NIST Chemistry WebBook:88495-63-0 KEGG DRUG:D02482 Reaxys:6003212 CASRN:88495-63-0 Wikipedia:Artesunate |
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| subClassOf |