Entecavir-(S)-Methylethyl Carboxylic Acid
Product Code
TRC-E559025-5MG
CAS Number
Product Format
Neat
Molecular Formula
C15 H19 N5 O5
Molecular Weight
349.342
Product Categories
Product Information
Chemical Data
Analyte Name
Entecavir-(S)-Methylethyl Carboxylic Acid
CAS Number
1415118-52-3
Molecular Formula
C15 H19 N5 O5
Molecular Weight
349.342
Accurate Mass
349.139
SMILES
C[C@H](NC1=Nc2c(ncn2[C@H]3C[C@H](O)[C@@H](CO)C3=C)C(=O)N1)C(=O)O
InChI
InChI=1S/C15H19N5O5/c1-6-8(4-21)10(22)3-9(6)20-5-16-11-12(20)18-15(19-13(11)23)17-7(2)14(24)25/h5,7-10,21-22H,1,3-4H2,2H3,(H,24,25)(H2,17,18,19,23)/t7-,8-,9-,10-/m0/s1
IUPAC
(2S)-2-[[9-[(1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl]-6-oxo-1H-purin-2-yl]amino]propanoic acid
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat