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Neuroscience Information Framework (NIF) Standard Ontology
Last uploaded:
February 10, 2018
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| Preferred Name | zanamivir | |
| Synonyms |
(2R,3R,4S)-3-(acetylamino)-4-carbamimidamido-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Relenza 5-acetamido-2,6-anhydro-3,4,5-trideoxy-4-guanidino-D-glycero-D-galacto-non-2-enonic acid 5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-D-glycero-D-galacto-non-2-enonic acid GANA 4-guanidino-2,4-dideoxy-2,3-dehydro-N-acetylneuraminic acid 4-guanidino-Neu5Ac2en zanamivir ZANAMIVIR 5-acetamido-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-D-glycero-D-galacto-non-2-enonic acid |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_50663 |
|
| alternative label |
(2R,3R,4S)-3-(acetylamino)-4-carbamimidamido-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Relenza 5-acetamido-2,6-anhydro-3,4,5-trideoxy-4-guanidino-D-glycero-D-galacto-non-2-enonic acid 5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-D-glycero-D-galacto-non-2-enonic acid GANA 4-guanidino-2,4-dideoxy-2,3-dehydro-N-acetylneuraminic acid 4-guanidino-Neu5Ac2en zanamivir ZANAMIVIR 5-acetamido-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-D-glycero-D-galacto-non-2-enonic acid
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|
| charge |
0
|
|
| database_cross_reference |
Wikipedia:Zanamivir KEGG:C08095 KEGG:D00902 DrugBank:DB00558 Drug_Central:2859 Patent:US5360817 Beilstein:7083099 PDBeChem:ZMR Patent:WO9116320 CAS:139110-80-8
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|
| formula |
C12H20N4O7
|
|
| has characteristic | ||
| has exact synonym |
ZANAMIVIR 5-acetamido-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-D-glycero-D-galacto-non-2-enonic acid
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|
| has role | ||
| has_alternative_id |
CHEBI:46607 CHEBI:10104
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| has_obo_namespace |
chebi_ontology
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| has_related_synonym |
(2R,3R,4S)-3-(acetylamino)-4-carbamimidamido-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Relenza 5-acetamido-2,6-anhydro-3,4,5-trideoxy-4-guanidino-D-glycero-D-galacto-non-2-enonic acid 5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-D-glycero-D-galacto-non-2-enonic acid GANA 4-guanidino-2,4-dideoxy-2,3-dehydro-N-acetylneuraminic acid 4-guanidino-Neu5Ac2en zanamivir
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|
| id |
CHEBI:50663
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|
| in_subset | ||
| inchi |
InChI=1S/C12H20N4O7/c1-4(18)15-8-5(16-12(13)14)2-7(11(21)22)23-10(8)9(20)6(19)3-17/h2,5-6,8-10,17,19-20H,3H2,1H3,(H,15,18)(H,21,22)(H4,13,14,16)/t5-,6+,8+,9+,10+/m0/s1
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| inchikey |
ARAIBEBZBOPLMB-UFGQHTETSA-N
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|
| label |
zanamivir
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|
| mass |
332.30996
|
|
| monoisotopicmass |
332.13320
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|
| notation |
CHEBI:50663
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|
| preferred label |
zanamivir
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|
| prefLabel |
zanamivir
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|
| smiles |
[H][C@]1(OC(=C[C@H](NC(N)=N)[C@H]1NC(C)=O)C(O)=O)[C@H](O)[C@H](O)CO
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| subClassOf |
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