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Chondrosamine, 6-phosphate

CAT: 0931-TN11476-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TN11476-01Size:10 mg
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CAS Number
45170-71-6
Target
Endogenous Metabolite
Related Pathways
Metabolism
Bioactivity
Chondrosamine, 6-phosphate is an aminoglycoside phosphate compound involved in carbohydrate metabolism and amino sugar metabolic pathways.
Smiles
[C@@H]([C@@H]([C@H](C=O)N)O)([C@@H](COP(=O)(O)O)O)O
Molecular Formula
C6H14NO8P
Molecular Weight
259.15
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

[(2R,3R,4R,5R)-5-amino-2,3,4-trihydroxy-6-oxohexyl] dihydrogen phosphate
CAS Number45170-71-6
PubChem CID87073466
IUPAC Name[(2R,3R,4R,5R)-5-amino-2,3,4-trihydroxy-6-oxohexyl] dihydrogen phosphate
Molecular FormulaC6H14NO8P
Molecular Weight259.15
XLogP-7.1
Topological Polar Surface Area171
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Heavy Atom Count16
Formal Charge0
Complexity267
SMILES
C([C@H]([C@@H]([C@@H]([C@H](C=O)N)O)O)O)OP(=O)(O)O
InChI
InChI=1S/C6H14NO8P/c7-3(1-8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,9-11H,2,7H2,(H2,12,13,14)/t3-,4+,5+,6-/m0/s1
InChIKey
AEJSSXDYDSUOOZ-KCDKBNATSA-N
Chemical Structure
2D Structure
2D structure of [(2R,3R,4R,5R)-5-amino-2,3,4-trihydroxy-6-oxohexyl] dihydrogen phosphate
CAS: 45170-71-6
CID: 87073466
Formula: C6H14NO8P
MW: 259.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight259.15
XLogP3-7.1
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Exact Mass259.04570340
Monoisotopic Mass259.04570340
Topological Polar Surface Area171 Ų
Heavy Atom Count16
Formal Charge0
Complexity267
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes