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Kasugamycin (hydrochloride)

CAT: 0607-C5503-10000Size: 10 gDry Ice: NoHazardous: No
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CAT#:0607-C5503-10000Size:10 g
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Description
aminoglycosidic antibiotic
CAS Number
19408-46-9
Product Name Alternative
3-O-[2-amino-4-[(carboxyiminomethyl)amino]-2,3,4,6-tetradeoxy-α-D-arabino-hexopyranosyl]-D-chiro-inositol, monohydrochloride
Field of Research
Microbiology & Virology Antibiotic
Purity
0.98
Solubility
insoluble in EtOH; insoluble in DMSO; ≥41.6 mg/mL in H2O with gentle warming
Smiles
O[C@H]1[C@@H](O)[C@H](O)[C@H](O)[C@@H](O[C@@]2([H])O[C@H](C)[C@@H](NC(C(O)=O)=N)C[C@@H]2N)[C@@H]1O.Cl
Molecular Formula
C14H25N3O9·HCl
Molecular Weight
415.8
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Kasugamycin hydrochloride

See also: Kasugamycin hydrochloride (annotation moved to) ... View More ...

CAS Number19408-46-9
PubChem CID88045
IUPAC Name2-amino-2-[(2R,3S,5S,6R)-5-amino-2-methyl-6-[(2R,3S,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyoxan-3-yl]iminoacetic acid;hydrochloride
Molecular FormulaC14H26ClN3O9
Molecular Weight415.82
Topological Polar Surface Area221
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity532
SMILES
C[C@@H]1[C@H](C[C@@H]([C@H](O1)OC2[C@@H]([C@H](C([C@@H]([C@@H]2O)O)O)O)O)N)N=C(C(=O)O)N.Cl
InChI
InChI=1S/C14H25N3O9.ClH/c1-3-5(17-12(16)13(23)24)2-4(15)14(25-3)26-11-9(21)7(19)6(18)8(20)10(11)22;/h3-11,14,18-22H,2,15H2,1H3,(H2,16,17)(H,23,24);1H/t3-,4+,5+,6?,7+,8+,9-,10+,11?,14-;/m1./s1
InChIKey
ZDRBJJNXJOSCLR-YZKQBBCCSA-N
Chemical Structure
2D Structure
2D structure of Kasugamycin hydrochloride
CAS: 19408-46-9
CID: 88045
Formula: C14H26ClN3O9
MW: 415.82
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight415.82
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Exact Mass415.1357571
Monoisotopic Mass415.1357571
Topological Polar Surface Area221 Ų
Heavy Atom Count27
Formal Charge0
Complexity532
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes