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Seldomycin factor 2

CAT: 0804-HY-N13961Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-N13961Size:1 Each
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Description
Seldomycin factor 2 (XK 88-2) is an aminoglycoside antibiotic. Seldomycin factor 2 has a broad spectrum of antimicrobial activity[1].
CAS Number
54333-78-7
Product Name Alternative
XK-88-2
UNSPSC
12352005
Target
Antibiotic; Bacterial
Related Pathways
Anti-infection
Field of Research
Infection
Smiles
O[C@@H]1[C@H]([C@@H]([C@H](C[C@H]1N)N)O[C@@H]2[C@@H]([C@H](C[C@H](O2)CN)O)N)O
Molecular Formula
C12H26N4O5
Molecular Weight
306.36
References & Citations
[1]R S Egan, et al. A new aminoglycoside antibiotic complex--the seldomycins. III. The structures of seldomycin factors 1 and 2+. J Antibiot (Tokyo) . 1977 Jan;30 (1) :31-8.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

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...
View on PubChemRaw 3D data
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

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