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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H17N5O4
Molecular Weight 307.3052
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-METHOXY ENTECAVIR

SMILES

COC1=NC2=C(N=C(N)NC2=O)N1[C@H]3C[C@H](O)[C@@H](CO)C3=C

InChI

InChIKey=STXDLYSFRKKGPP-FXQIFTODSA-N
InChI=1S/C13H17N5O4/c1-5-6(4-19)8(20)3-7(5)18-10-9(15-13(18)22-2)11(21)17-12(14)16-10/h6-8,19-20H,1,3-4H2,2H3,(H3,14,16,17,21)/t6-,7-,8-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H17N5O4
Molecular Weight 307.3052
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:41:18 UTC 2023
Edited
by admin
on Sat Dec 16 18:41:18 UTC 2023
Record UNII
YJD4DV9LHH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-METHOXY ENTECAVIR
Common Name English
2-AMINO-1,9-DIHYDRO-9-((1S,3R,4S)-4-HYDROXY-3-(HYDROXYMETHYL)-2-METHYLENECYCLOPENTYL)-8-METHOXY-6H-PURIN-6-ONE
Systematic Name English
ENTECAVIR MONOHYDRATE IMPURITY E [EP IMPURITY ]
Common Name English
6H-PURIN-6-ONE, 2-AMINO-1,9-DIHYDRO-9-((1S,3R,4S)-4-HYDROXY-3-(HYDROXYMETHYL)-2-METHYLENECYCLOPENTYL)-8-METHOXY-
Systematic Name English
8-METHOXY-9-((1S,3R,4S)-4-HYDROXY-3-(HYDROXYMETHYL)-2-METHYLENECYCLOPENTYL)GUANINE
Systematic Name English
8-METHOXY ENTECAVIR [USP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
137184360
Created by admin on Sat Dec 16 18:41:18 UTC 2023 , Edited by admin on Sat Dec 16 18:41:18 UTC 2023
PRIMARY
FDA UNII
YJD4DV9LHH
Created by admin on Sat Dec 16 18:41:18 UTC 2023 , Edited by admin on Sat Dec 16 18:41:18 UTC 2023
PRIMARY
CAS
2349444-69-3
Created by admin on Sat Dec 16 18:41:18 UTC 2023 , Edited by admin on Sat Dec 16 18:41:18 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP