Dihydrostreptomycin sulfate
bis(2-[(1R,2R,3S,4R,5R,6S)-3-(diaminomethylideneamino)-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-hydroxy-4-(hydroxymethyl)-5-methyloxolan-2-yl]oxy-2,5,6-trihydroxycyclohexyl]guanidine);sulfuric acid
| Molecular Formula | C42H88N14O36S3 |
|---|---|
| Molecular Weight | 1461.4 g/mol |
| Topological Polar Surface Area | 928.0 A2 |
| Hydrogen Bond Donors | 32 |
| Hydrogen Bond Acceptors | 42 |
| Rotatable Bonds | 18 |
| Exact Mass | 1460.4647 |
| Heavy Atoms | 95 |
| Complexity | 993.0 |
Chemical Identifiers
| CAS Number | 5490-27-7 |
|---|---|
| SMILES | CC1C(C(C(O1)OC2C(C(C(C(C2O)O)N=C(N)N)O)N=C(N)N)OC3C(C(C(C(O3)CO)O)O)NC)(CO)O.CC1C(C(C(O1)OC2C(C(C(C(C2O)O)N=C(N)N)O)N=C(N)N)OC3C(C(C(C(O3)CO)O)O)NC)(CO)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O |
| InChIKey | CZWJCQXZZJHHRH-YCRXJPFRSA-N |
📖 Product Overview
Dihydrostreptomycin sulfate (CAS: 5490-27-7) is a chemical compound with molecular formula C42H88N14O36S3 and molecular weight 1461.4 g/mol. Its IUPAC systematic name is bis(2-[(1R,2R,3S,4R,5R,6S)-3-(diaminomethylideneamino)-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-hydroxy-4-(hydroxymethyl)-5-methyloxolan-2-yl]oxy-2,5,6-trihydroxycyclohexyl]guanidine);sulfuric acid.
CZWJCQXZZJHHRH-YCRXJPFRSA-N.
SMILES: CC1C(C(C(O1)OC2C(C(C(C(C2O)O)N=C(N)N)O)N=C(N)N)OC3C(C(C(C(O3)CO)O)O)NC)(CO)O.CC1C(C(C(O1)OC2C(C(C(C(C2O)O)N=C(N)N)O)N=C(N)N)OC3C(C(C(C(O3)CO)O)O)NC)(CO)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.
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