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Home > Indoles and Oxindole > 173099-58-6
173099-58-6 | Uridine, 2'-deoxy-2'-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)- (9CI)
CAS No: 173099-58-6 Catalog No: AG001YLG MDL No:
Product Description
Catalog Number:
AG001YLG
Chemical Name:
Uridine, 2'-deoxy-2'-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)- (9CI)
CAS Number:
173099-58-6
Molecular Formula:
C17H15N3O7
Molecular Weight:
373.3169
IUPAC Name:
2-[(2R,3R,4S,5R)-2-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]isoindole-1,3-dione
InChI:
InChI=1S/C17H15N3O7/c21-7-10-13(23)12(16(27-10)19-6-5-11(22)18-17(19)26)20-14(24)8-3-1-2-4-9(8)15(20)25/h1-6,10,12-13,16,21,23H,7H2,(H,18,22,26)/t10-,12-,13-,16-/m1/s1
InChI Key:
OTBXGAQZHWYAOI-XNIJJKJLSA-N
SMILES:
OC[C@H]1O[C@H]([C@@H]([C@@H]1O)N1C(=O)c2c(C1=O)cccc2)n1ccc(=O)[nH]c1=O
Properties
Complexity:
699
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
373.091g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
373.321g/mol
Monoisotopic Mass:
373.091g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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