Carbathymidine structure

Carbathymidine

1-[(1S,3R,4S)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]-5-methylpyrimidine-2,4-dione

Also Known As: Carbathymidine|2,4(1H,3H)-Pyrimidinedione, 1-[3-hydroxy-4-(hydroxymethyl)cy|1-[(1S,3R,4S)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]-5-methyl-pyrimidine-2,4-dione|1-[(1S,3R,4S)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]-5-methylpyrimidine-2,4-dione|(-)-1-((1S,3R,4S)-3-Hydroxy-4-hydroxymethyl-cyclopentyl)-5-methyl-1-H-pyrimidine-2,4-dione|(-)-1-[(1S)-3beta-Hydroxy-4alpha-hydroxymethylcyclopentyl]-5-methylpyrimidine-2,4(1H,3H)-dione|1-[(1S,3R,4S)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione|1-[(1S,3R,4S)-3-Hydroxy-4-(hydroxymethyl)cyclopentyl]-5-methyl-2,4(1H,3H)-pyrimidinedione|1-[(1s,3r,4s)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]-5-methylpyrimidine-2,4(1h,3h)-dione

CAS: 61849-27-2
Molecular Formula C11H16N2O4
Molecular Weight 240.11101 g/mol
LogP -0.4
Topological Polar Surface Area 89.9 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 240.11101
Monoisotopic Mass 240.11101
Heavy Atoms 17
Complexity 380.0

Chemical Identifiers

CAS Number 61849-27-2
SMILES CC1=CN(C(=O)NC1=O)[C@H]2C[C@H]([C@@H](C2)O)CO
InChIKey ZOZRLTAJWLEGLG-XHNCKOQMSA-N

Product Overview

Carbathymidine (CAS 61849-27-2), with molecular formula C11H16N2O4 and molecular weight 240.11101 g/mol. IUPAC: 1-[(1S,3R,4S)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]-5-methylpyrimidine-2,4-dione.

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