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119753-64-9 | Uridine, 2',3'-dideoxy-2'-(1-pyrrolidinyl)- (9CI)
CAS No: 119753-64-9 Catalog No: AG000PLQ MDL No:
Product Description
Catalog Number:
AG000PLQ
Chemical Name:
Uridine, 2',3'-dideoxy-2'-(1-pyrrolidinyl)- (9CI)
CAS Number:
119753-64-9
Molecular Formula:
C13H19N3O4
Molecular Weight:
281.3077
IUPAC Name:
1-[(2R,3R,5S)-5-(hydroxymethyl)-3-pyrrolidin-1-yloxolan-2-yl]pyrimidine-2,4-dione
InChI:
InChI=1S/C13H19N3O4/c17-8-9-7-10(15-4-1-2-5-15)12(20-9)16-6-3-11(18)14-13(16)19/h3,6,9-10,12,17H,1-2,4-5,7-8H2,(H,14,18,19)/t9-,10+,12+/m0/s1
InChI Key:
VCNWCIHODWLEBT-HOSYDEDBSA-N
SMILES:
OC[C@H]1O[C@H]([C@@H](C1)N1CCCC1)n1ccc(=O)[nH]c1=O
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
281.138g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.312g/mol
Monoisotopic Mass:
281.138g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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