Butirosin A
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Butirosin A
structure -
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CAS No:
34291-02-6
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Formula:
C21H41N5O12
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Chemical Name:
Butirosin A
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Synonyms:
D-Streptamine,O-2,6-diamino-2,6-dideoxy-α-D-glucopyranosyl-(1→4)-O-[β-D-xylofuranosyl-(1→5)]-N1-[(2S)-4-amino-2-hydroxy-1-oxobutyl]-2-deoxy-;Ambutyrosin A;O-2,6-Diamino-2,6-dideoxy-α-D-glucopyranosyl-(1→4)-O-[β-D-xylofuranosyl-(1→5)]-N1-[(2S)-4-amino-2-hydroxy-1-oxobutyl]-2-deoxy-D-streptamine;Butirosin A;Butyrosin A;27597-57-5;28270-16-8
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CAS No:
Description
ChEBI: A butirosin that consists of neamine in which is substituted at position 2 by a beta-D-xylofuranosyl and at position 4 by an (S)-2-hydroxy-4-aminobutyryl group.
Characteristics
312
-7.3
1.58g/cm3
947.4ºC at 760mmHg
526.8ºC
1.657
2-8°C
Abdominal-mouse LD50: 2198 mg/kg; intravenous-mouse LD50: 580 mg/kg
Thermal decomposition to emit toxic nitrogen oxide fumes
D25 +26° (c = 1.46 in water)
Safety Information
3
61-20/21/22
53-22-36/37/39-45
WK2302000
T
Warehouse ventilated, low temperature and dry
P201, P202, P261, P264, P270, P271, P280, P281, P301+P312, P302+P352, P304+P312, P304+P340, P308+P313, P312, P322, P330, P363, P405, P501
H302
Computed Properties
Molecular Weight:555.6
XLogP3:-7.3
Hydrogen Bond Donor Count:12
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:10
Exact Mass:555.27517176
Monoisotopic Mass:555.27517176
Topological Polar Surface Area:312
Heavy Atom Count:38
Complexity:772
Undefined Atom Stereocenter Count:15
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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