AC1MHEKQ
4-amino-N-[5-amino-2-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[3-amino-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide
Also Known As: 1-N-((S)-4-Amino-2-hydroxybutyryl)-3',4'-deoxykanamycin C hydrate|D-Streptamine, O-3-amino-3-deoxy-alpha-D-glucopyranosyl)-(1-6)-O-(2-amino-2,3,4-trideoxy-alpha-D-erythro-hexopyranosyl-(1-4)-N(sup 1)-(4-amino-2-hydroxy-1-oxobutyl)-2-deoxy-, (S)-, hydrate|4-amino-N-[5-amino-2-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[3-amino-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide|4-Amino-N-{5-amino-2-[(3-amino-3-deoxyhexopyranosyl)oxy]-4-[(2-amino-2,3,4-trideoxyhexopyranosyl)oxy]-3-hydroxycyclohexyl}-2-hydroxybutanimidic acid
| Molecular Formula | C22H43N5O11 |
|---|---|
| Molecular Weight | 553.2959 g/mol |
| LogP | -6.3658 |
| Topological Polar Surface Area | 291.48 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 553.2959 |
| Monoisotopic Mass | 553.2959 |
| Heavy Atoms | 38 |
| Complexity | 754.47723 |
Chemical Identifiers
| CAS Number | 65566-79-2 |
|---|---|
| SMILES | C1CC(C(OC1CO)OC2C(CC(C(C2O)OC3C(C(C(C(O3)CO)O)N)O)NC(=O)C(CCN)O)N)N |
Product Overview
AC1MHEKQ (CAS 65566-79-2), with molecular formula C22H43N5O11 and molecular weight 553.2959 g/mol. IUPAC: 4-amino-N-[5-amino-2-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[3-amino-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide.
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