Basic information
- CAS
31077-71-1- Standard SMILES
NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](O)[C@@H]1O- InChIKey
AWRLKTYNEGEURZ-JCLMPDJQSA-N- Molecular formula
- C12H25N3O7
- Average molar mass
- 323.34 g/mol
- Monoisotopic mass
- 323.16925015
Overview
2'-deamino-2'-hydroxyneamine is an amino cyclitol glycoside that is 2-deoxystreptamine in which the pro-R hydroxy group is substituted by a 6-amino-6-deoxy-alpha-D-glucosyl residue. It has a role as an antimicrobial agent. It is functionally related to a 2-deoxystreptamine. It is a conjugate base of a 2'-deamino-2'-hydroxyneamine(3+).
Names & identifiers
- Preferred name
- 2'-Deamino-2'-hydroxyneamine
- IUPAC
- (2R,3S,4S,5R,6R)-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl]oxyoxane-3,4,5-triol
- English name
- 4-O-(6-Amino-6-deoxy-α-D-glucopyranosyl)-2-deoxy-D-streptamine
- Molecular formula
- C12H25N3O7
- Molecular weight
- 323.34
Names & synonyms
Kanamine2'-Deamino-2'-hydroxyneamine31077-71-1Antibiotic NK 1003Streptamine, 4-O-(6-amino-6-deoxy-alpha-D-glucopyranosyl)-2-deoxy-, D-CHEBI:67223(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl 6-amino-6-deoxy-alpha-D-glucopyranoside4-O-(6-amino-6-deoxy-alpha-D-glucopyranosyl)-2-deoxystreptamineRefChem:80228NK 10034-O-(6-Amino-6-deoxy-alpha-D-glucopyranosyl)-2-deoxy-D-streptamine(2R,3S,4S,5R,6R)-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl]oxyoxane-3,4,5-triol
Show more names
NK-1003kanamine AAntibiotic NK-1003Kanamycin Impurity 2Kanamycin Impurity 1Kanamycin A Related Compound 14-O-(6-Amino-6-deoxy-α-D-glucopyranosyl)-2-deoxy-D-streptamineD-Streptamine, 4-O-(6-amino-6-deoxy-α-D-glucopyranosyl)-2-deoxy-
Kanamycin A Related Compound 1 Triacetate64NX2HZ4GW2'-deamino-2'-hydroxy-neamineSCHEMBL28885267DTXSID90953177OK577991407159-21-0C20350
Properties
Computed structural properties
- XLogP
- -5.1
- Topological polar surface area
- 198 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 377
Physicochemical properties
- Boiling point
- 579.1 · 579.1±50.0 °C(Predicted)
- Density
- 1.56 · 1.56±0.1 g/cm3(Predicted)
- pka
- 12.94 · 12.94±0.70(Predicted)
Chemistry & industry
Suppliers8 total
济南百隆化学有限公司[email protected] · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
北京秦岭医药科技有限公司010-61241352 18901327973 · [email protected]
Standardpharm Co. Ltd.86-714-3992388 · [email protected]
BOC Sciences16314854226 · [email protected]
Additional notes
DefinitionChEBI: An amino cyclitol glycoside that is 2-deoxystreptamine in which the pro-R hydroxy group is substituted by a 6-amino-6-deoxy-alpha-D-glucosyl residue.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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