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14062-44-3 | Ribofuranose, 4-acetamido-4-deoxy-, 1,5-diacetate 2,3-dibenzoate, D- (8CI)
CAS No: 14062-44-3 Catalog No: AG001CL7 MDL No:
Product Description
Catalog Number:
AG001CL7
Chemical Name:
Ribofuranose, 4-acetamido-4-deoxy-, 1,5-diacetate 2,3-dibenzoate, D- (8CI)
CAS Number:
14062-44-3
Molecular Formula:
C25H25NO9
Molecular Weight:
483.4673
IUPAC Name:
[1-acetyl-5-acetyloxy-2-(acetyloxymethyl)-4-benzoyloxypyrrolidin-3-yl] benzoate
InChI:
InChI=1S/C25H25NO9/c1-15(27)26-20(14-32-16(2)28)21(34-24(30)18-10-6-4-7-11-18)22(23(26)33-17(3)29)35-25(31)19-12-8-5-9-13-19/h4-13,20-23H,14H2,1-3H3
InChI Key:
VJXZAZDWFSMUOO-UHFFFAOYSA-N
SMILES:
CC(=O)OCC1C(OC(=O)c2ccccc2)C(C(N1C(=O)C)OC(=O)C)OC(=O)c1ccccc1
NSC Number:
91040
Properties
Complexity:
801
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
483.153g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
483.473g/mol
Monoisotopic Mass:
483.153g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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