66-40D
2-[4,6-diamino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-2-hydroxycyclohexyl]oxy-4-(methylamino)oxane-3,5-diol
Also Known As: Sisomicin-B|Sisomicin B|Antibiotic 66-40D|Sisomicin D|66-40D|6640B|2-[4,6-diamino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-2-hydroxycyclohexyl]oxy-4-(methylamino)oxane-3,5-diol|D-Streptamine, O-3-deoxy-3-(methylamino)-alpha-D-xylopyranosyl-(1-6)-O-(2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-glycero-hex-4-enopyranosyl-(1-4))-2-deoxy-|2-[4,6-diamino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-2-hydroxy-cyclohexyl]oxy-4-methylamino-oxane-3,5-diol|4,6-Diamino-3-{[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy}-2-hydroxycyclohexyl 3-deoxy-3-(methylamino)pentopyranoside|6-O-[3-Deoxy-3-(methylamino)-beta-L-arabinopyranosyl]-4-O-(2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-glycero-hexa-4-enopyranosyl)-2-deoxy-D-streptamine|D-Streptamine, O-3-deoxy-3-(methylamino)-.alpha.-D-xylopyranosyl-(1.fwdarw.6)-O-[2,6-diamino-2,3,4,6-tetradeoxy-.alpha.-D-glycero-hex-4-enopyranosyl-(1.fwdarw.4)]-2-deoxy-|D-Streptamine, O-3-deoxy-3-(methylamino)-.beta.-L-arabinopyranosyl-(1.fwdarw.6)-O-[2,6-diamino-2,3,4,6-tetradeoxy-.alpha.-D-glycero-hex-4-enopyranosyl-(1.fwdarw.4)]-2-deoxy-
| Molecular Formula | C18H35N5O7 |
|---|---|
| Molecular Weight | 433.25366 g/mol |
| LogP | -4.2416 |
| Topological Polar Surface Area | 213.72 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.25366 |
| Monoisotopic Mass | 433.25366 |
| Heavy Atoms | 30 |
| Complexity | 599.2726 |
Chemical Identifiers
| CAS Number | 53797-16-3 |
|---|---|
| SMILES | CNC1C(COC(C1O)OC2C(CC(C(C2O)OC3C(CC=C(O3)CN)N)N)N)O |
Product Overview
66-40D (CAS 53797-16-3), with molecular formula C18H35N5O7 and molecular weight 433.25366 g/mol. IUPAC: 2-[4,6-diamino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-2-hydroxycyclohexyl]oxy-4-(methylamino)oxane-3,5-diol.
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