Geneticin
C20H40N4O10
49863-47-0 Copyright (C) 2024 ACS
 35 37  0  0  1  0  0  0  0  0999 V2000
   11.0969    5.5177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5569    8.1849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5569    2.8502    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4769    8.1849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9369    5.5177    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.1769    5.5177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7169    2.8502    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.4869    4.1840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9369   10.8524    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.1394    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8541    0.9899    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1798    6.3246    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0000    7.3145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9123    4.8080    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8569   10.8524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3169    8.1849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5569    5.5177    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.7869    6.8513    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.7869    4.1840    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2469    6.8513    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2469    4.1840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4769    5.5177    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.8669    4.1840    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   13.4069    4.1840    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.0969    2.8502    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1769    2.8502    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.8669    1.5166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4069    1.5166    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.9369    8.1849    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.1669    6.8513    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1669    9.5187    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6269    6.8513    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6269    9.5187    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.8569    8.1849    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8943    5.3347    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
 17  1  1  1  0  0  0
 23  1  1  6  0  0  0
 18  2  1  6  0  0  0
 19  3  1  6  0  0  0
 20  4  1  1  0  0  0
 29  4  1  1  0  0  0
 22  5  1  6  0  0  0
 24  6  1  6  0  0  0
  7  8  1  0  0  0  0
 26  7  1  1  0  0  0
 31  9  1  1  0  0  0
 28 10  1  6  0  0  0
 28 11  1  1  0  0  0
 12 13  1  0  0  0  0
 12 14  1  6  0  0  0
 12 32  1  0  0  0  0
 33 15  1  6  0  0  0
 34 16  1  1  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 22  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
 26 28  1  0  0  0  0
 27 28  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 30 32  1  0  0  0  0
 31 33  1  0  0  0  0
 32 34  1  0  0  0  0
 32 35  1  1  0  0  0
 33 34  1  0  0  0  0
M  END
> <cas.rn>
49863-47-0

> <cas.index.name>
D-Streptamine, O-2-amino-2,7-dideoxy-D-glycero-α-D-gluco-heptopyranosyl-(1→4)-O-[3-deoxy-4-C-methyl-3-(methylamino)-β-L-arabinopyranosyl-(1→6)]-2-deoxy-

> <molecular.formula>
C20H40N4O10

> <molecular.weight>
496.55

> <boiling.point.predicted>
760.315±60.00 °C    Press: 760.00 Torr

> <density.predicted>
1.476±0.10 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
13.288±0.70    Most Acidic Temp: 25 °C

$$$$
