Chemical Component Summary | |
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Name | ZANAMIVIR |
Synonyms | 4-GUANIDINO-2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID; 4-guanidino-Neu5Ac2en; MODIFIED SIALIC ACID |
Identifiers | (2~{R},3~{R},4~{S})-3-acetamido-4-carbamimidamido-2-[(1~{R},2~{R})-1,2,3-tris(oxidanyl)propyl]-3,4-dihydro-2~{H}-pyran- 6-carboxylic acid |
Formula | C12 H20 N4 O7 |
Molecular Weight | 332.31 |
Type | D-SACCHARIDE |
Isomeric SMILES | [H]/N=C(\N)/N[C@H]1C=C(O[C@H]([C@@H]1NC(=O)C)[C@@H]([C@@H](CO)O)O)C(=O)O |
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 |
InChIKey | ARAIBEBZBOPLMB-UFGQHTETSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 43 |
Chiral Atom Count | 5 |
Bond Count | 43 |
Aromatic Bond Count | 0 |
Drug Info: DrugBank
DrugBank ID | DB00558? |
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Name | Zanamivir |
Groups |
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Description | A guanido-neuraminic acid that is used to inhibit neuraminidase. |
Synonyms |
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Brand Names |
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Indication | For the prevention and treatment of influenza A and B. |
Categories |
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ATC-Code | J05AH01 |
CAS number | 139110-80-8 |
Drug Targets
Name | Target Sequence | Pharmacological Action | Actions |
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Neuraminidase | MNPNQKIITIGSVSLTIATICFLMQIAILVTTVTLHFKQYECSSPPNNQV... | unknown | inhibitor |
Neuraminidase | MLPSTIQTLTLFLTSGGVLLSLYVSASLSYLLYSDILLKFSSKITAPTMT... | unknown | inhibitor |
Sialidase-2 | MASLPVLQKESVFQSGAHAYRIPALLYLPGQQSLLAFAEQRASKKDEHAE... | unknown | inhibitor |
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison
T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS.
Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682
Related Resource References
Resource Name | Reference |
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Pharos | CHEMBL222813 |
PubChem | 60855, 40469135 |
ChEMBL | CHEMBL222813 |
ChEBI | CHEBI:50663 |