Home Halogens D-glycero-D-galacto-2-Nonulopyranosonic acid, 5-(acetylaMino)-2-chloro-2,3,5-trideoxy-, Methyl ester, 4,7,8,9-tetraacetate

D-glycero-D-galacto-2-Nonulopyranosonic acid, 5-(acetylaMino)-2-chloro-2,3,5-trideoxy-, Methyl ester, 4,7,8,9-tetraacetate

CAS No.:
132883-18-2
Catalog Number:
AG009CB0
Molecular Formula:
C20H28ClNO12
Molecular Weight:
509.8888
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Product Description
Catalog Number:
AG009CB0
Chemical Name:
D-glycero-D-galacto-2-Nonulopyranosonic acid, 5-(acetylaMino)-2-chloro-2,3,5-trideoxy-, Methyl ester, 4,7,8,9-tetraacetate
CAS Number:
132883-18-2
Molecular Formula:
C20H28ClNO12
Molecular Weight:
509.8888
MDL Number:
MFCD09038494
IUPAC Name:
methyl 5-acetamido-4-acetyloxy-2-chloro-6-(1,2,3-triacetyloxypropyl)oxane-2-carboxylate
InChI:
InChI=1S/C20H28ClNO12/c1-9(23)22-16-14(31-11(3)25)7-20(21,19(28)29-6)34-18(16)17(33-13(5)27)15(32-12(4)26)8-30-10(2)24/h14-18H,7-8H2,1-6H3,(H,22,23)
InChI Key:
QGJGGAMXXWIKJR-UHFFFAOYSA-N
SMILES:
COC(=O)C1(Cl)C[C@H](OC(=O)C)[C@H]([C@@H](O1)[C@@H]([C@H](OC(=O)C)COC(=O)C)OC(=O)C)NC(=O)C
Properties
Complexity:
817  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
509.13g/mol
Formal Charge:
0
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
509.889g/mol
Monoisotopic Mass:
509.13g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
170A^2
Undefined Atom Stereocenter Count:
6  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties