Zanamivir monohydrate
(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid;hydrate
Molecular Identity
Zanamivir monohydrate
(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid;hydrate
PubChem CID: 636424
Zanamivir hydrate is a member of acetamides.
2D Structure
Properties
C12H22N4O8
Molecular Formula
350.33
Molecular Weight
g/mol
350.1438
Exact Mass
Da
202
TPSA
May have limited oral absorption
8
H-Bond Donors
9
H-Bond Acceptors
518
Complexity
SMILES
Canonical SMILES
SMILES: CC(=O)NC1C(C=C(OC1C(C(CO)O)O)C(=O)O)N=C(N)N.OIsomeric SMILES
SMILES: CC(=O)N[C@@H]1[C@H](C=C(O[C@H]1[C@@H]([C@@H](CO)O)O)C(=O)O)N=C(N)N.OSynonyms(20)
1260601-68-0Zanamivir monohydrateRefChem:904797849-258-3Zanamivir hydrate551942-41-7Zanamivir hydrate [JAN]J1.917.534KD01937171094-50-19E25RDB1Q0(+)-(4S,5R,6R)-5-Acetylamino-4-guanidino-6-((1R,2R)-1,2,3- trihydroxypropyl)-5,6-dihydro-4H-pyran-2-carboxylic acid hydrate(2R,3R,4S)-3-Acetamido-4-guanidino-2-((1R,2R)-1,2,3-trihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylic acid hydrateD-glycero-D-galacto-Non-2-enonic acid, 5-(acetylamino)-4-[(aminoiminomethyl)amino]-2,6-anhydro-3,4,5-trideoxy-, hydrate (1:1)(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid;hydrate
Data from PubChem (NCBI)
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