Streptomycylamine structure

Streptomycylamine

2-[2-[4-(aminomethyl)-3-[4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-hydroxy-5-methyloxolan-2-yl]oxy-5-(diaminomethylideneamino)-3,4,6-trihydroxycyclohexyl]guanidine

Also Known As: Streptomycylamine|2-[2-[4-(aminomethyl)-3-[4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-hydroxy-5-methyloxolan-2-yl]oxy-5-(diaminomethylideneamino)-3,4,6-trihydroxycyclohexyl]guanidine|2,2'-[4-({3-c-(aminomethyl)-5-deoxy-2-o-[2-deoxy-2-(methylamino)hexopyranosyl]pentofuranosyl}oxy)-2,5,6-trihydroxycyclohexane-1,3-diyl]diguanidine|N,N'-[4-({3-C-(Aminomethyl)-5-deoxy-2-O-[2-deoxy-2-(methylamino)hexopyranosyl]pentofuranosyl}oxy)-2,5,6-trihydroxycyclohexane-1,3-diyl]diguanidinato|N,N'-[4-({3-C-(Aminomethyl)-5-deoxy-2-O-[2-deoxy-2-(methylamino)hexopyranosyl]pentofuranosyl}oxy)-2,5,6-trihydroxycyclohexane-1,3-diyl]diguanidine

CAS: 35911-17-2
Molecular Formula C21H42N8O11
Molecular Weight 582.2973 g/mol
LogP -8.4
Topological Polar Surface Area 345.0 Ų
Hydrogen Bond Donors 13
Hydrogen Bond Acceptors 15
Rotatable Bonds 9
Exact Mass 582.2973
Monoisotopic Mass 582.2973
Heavy Atoms 40
Complexity 912.0

Chemical Identifiers

CAS Number 35911-17-2
SMILES CC1C(C(C(O1)OC2C(C(C(C(C2O)O)N=C(N)N)O)N=C(N)N)OC3C(C(C(C(O3)CO)O)O)NC)(CN)O
InChIKey WXGWFKFUFMJVQM-UHFFFAOYSA-N

Product Overview

Streptomycylamine (CAS 35911-17-2), with molecular formula C21H42N8O11 and molecular weight 582.2973 g/mol. IUPAC: 2-[2-[4-(aminomethyl)-3-[4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-hydroxy-5-methyloxolan-2-yl]oxy-5-(diaminomethylideneamino)-3,4,6-trihydroxycyclohexyl]guanidine.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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