Aminoglycoside 66-40C
6,14,20,28-tetraamino-5,19-bis[[3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy]-2,16,29,30-tetraoxa-9,23-diazapentacyclo[23.3.1.111,15.03,8.017,22]triaconta-9,11,23,25-tetraene-4,18-diol
Also Known As: Aminoglycoside 66-40C|KST-1A7320|(11e,23z)-2,7,14,19-tetraamino-15-{[3-deoxy-4-c-methyl-3-(methylamino)pentopyranosyl]oxy}-4,16-dihydroxy-2,3,4,4a,7,8,12a,13,14,15,16,16a,18,19,20,24a-hexadecahydro-1h,6h-6,10:18,22-diepoxydibenzo[b,l[1,11,4,14]dioxadiazacycloicosin-3-yl 3-deoxy-4-c-methyl-3-(methylamino)pentopyranoside|6,14,20,28-tetraamino-5,19-bis[[3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy]-2,16,29,30-tetraoxa-9,23-diazapentacyclo[23.3.1.111,15.03,8.017,22]triaconta-9,11,23,25-tetraene-4,18-diol|beta-L-Arabinopyranoside, 2,7,14,19-tetraamino-2,3,4,4a,7,8,12a,13,14,15,16,16a,18,19,20,24a-hexadecahydro-4,16-dihydroxy-6,10:18,22-diepoxy-1H,6H-dibenzo(b,l)(1,11,4,14)dioxadiazacycloeicosine-3,15-diylbis(3-deoxy-4-C-methyl-3-(methylamino)-, (2R-(2R*,3S*,4R*,4aR*,6S*,7R*,12aS*,14R*,15S*,16R*,16aR*,18S*,19R*,24aS*))-
| Molecular Formula | C38H64N8O14 |
|---|---|
| Molecular Weight | 856.4542 g/mol |
| LogP | -7.3 |
| Topological Polar Surface Area | 348.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 6 |
| Exact Mass | 856.4542 |
| Monoisotopic Mass | 856.4542 |
| Heavy Atoms | 60 |
| Complexity | 1500.0 |
Chemical Identifiers
| CAS Number | 6641-52-7 |
|---|---|
| SMILES | CC1(COC(C(C1NC)O)OC2C(CC3C(C2O)OC4C(CC=C(O4)C=NC5CC(C(C(C5OC6C(CC=C(O6)C=N3)N)O)OC7C(C(C(CO7)(C)O)NC)O)N)N)N)O |
| InChIKey | OKDBJIDCKFMJCC-UHFFFAOYSA-N |
Product Overview
Aminoglycoside 66-40C (CAS 6641-52-7), with molecular formula C38H64N8O14 and molecular weight 856.4542 g/mol. IUPAC: 6,14,20,28-tetraamino-5,19-bis[[3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy]-2,16,29,30-tetraoxa-9,23-diazapentacyclo[23.3.1.111,15.03,8.017,22]triaconta-9,11,23,25-tetraene-4,18-diol.