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Seldomycin factor 2

CAT: 0013-GTR19255987-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19255987-01Size:50 mg
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Description
Seldomycin factor 2 (XK 88-2) is an aminoglycoside antibiotic with broad-spectrum antibacterial activity.
CAS Number
54333-78-7
Field of Research
Infectious Disease & Virology
Smiles
OC1CC (OC (OC2C (O) C (O) C (N) CC2N) C1N) CN
Molecular Formula
C12H26N4O5
Molecular Weight
306.359
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4,6-Diamino-2,3-dihydroxycyclohexyl 2,6-diamino-2,4,6-trideoxyhexopyranoside
CAS Number54333-78-7
PubChem CID3041557
IUPAC Name4,6-diamino-3-[3-amino-6-(aminomethyl)-4-hydroxyoxan-2-yl]oxycyclohexane-1,2-diol
Molecular FormulaC12H26N4O5
Molecular Weight306.36
XLogP-4.9
Topological Polar Surface Area183
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count9
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity350
SMILES
C1C(OC(C(C1O)N)OC2C(CC(C(C2O)O)N)N)CN
InChI
InChI=1S/C12H26N4O5/c13-3-4-1-7(17)8(16)12(20-4)21-11-6(15)2-5(14)9(18)10(11)19/h4-12,17-19H,1-3,13-16H2
InChIKey
NOBINJIDZDKGAE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4,6-Diamino-2,3-dihydroxycyclohexyl 2,6-diamino-2,4,6-trideoxyhexopyranoside
CAS: 54333-78-7
CID: 3041557
Formula: C12H26N4O5
MW: 306.36
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight306.36
XLogP3-4.9
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count9
Rotatable Bond Count3
Exact Mass306.19031994
Monoisotopic Mass306.19031994
Topological Polar Surface Area183 Ų
Heavy Atom Count21
Formal Charge0
Complexity350
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count9
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes