ENTECAVIR

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C12H15N5O3.H2O
Molecular Weight	295.2945
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ENTECAVIR

Structure Search

SMILES

O.NC1=NC2=C(N=CN2[C@H]3C[C@H](O)[C@@H](CO)C3=C)C(=O)N1

InChI

InChIKey=YXPVEXCTPGULBZ-WQYNNSOESA-N

InChI=1S/C12H15N5O3.H2O/c1-5-6(3-18)8(19)2-7(5)17-4-14-9-10(17)15-12(13)16-11(9)20;/h4,6-8,18-19H,1-3H2,(H3,13,15,16,20);1H2/t6-,7-,8-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C12H15N5O3
Molecular Weight	277.2792
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 `Fri Dec 15 16:10:08 UTC 2023` Edited by `admin` on `Fri Dec 15 16:10:08 UTC 2023`
Record UNII	5968Y6H45M
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ENTECAVIR

Official Name

English

SQ-34676

Code

English

ENTECAVIR MONOHYDRATE [USP-RS]

Common Name

English

ENTECAVIR MONOHYDRATE

Common Name

English

ENTECAVIR [USP MONOGRAPH]

Common Name

English

9-[(1S,3R,4S)-4-Hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]guanine monohydrate

Systematic Name

English

ENTECAVIR [USAN]

Common Name

English

ENTECAVIR [ORANGE BOOK]

Common Name

English

ENTECAVIR MONOHYDRATE [MI]

Common Name

English

ENTECAVIR HYDRATE

Common Name

English

6H-PURIN-6-ONE, 2-AMINO-1,9-DIHYDRO-9-((1S,3R,4S)-4-HYDROXY-3-(HYDROXYMETHYL)-2-METHYLENECYCLOPENTYL)- MONOHYDRATE

Systematic Name

English

ENTECAVIR MONOHYDRATE [EP MONOGRAPH]

Common Name

English

Entecavir monohydrate [WHO-DD]

Common Name

English

BARACLUDE

Brand Name

English

SQ34676

Code

English

ENTECAVIR [EMA EPAR]

Common Name

English

BMS-200475-01

Code

English

ENTECAVIR [VANDF]

Common Name

English

ENTECAVIR HYDRATE [JAN]

Common Name

English

ENTECAVIR [MART.]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C97452

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

WHO-VATC

QJ05AF10

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

WHO-ATC

J05AF10

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

LIVERTOX

NBK548075

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

EMA ASSESSMENT REPORTS

BARACLUDE (AUTHORIZED: HEPATITIS B, CHRONIC)

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

NDF-RT

N0000175656

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

Code System Code Type Description

CAS

209216-23-9

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

EPA CompTox

DTXSID00943185

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

ChEMBL

CHEMBL713

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

RXCUI

306266

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

RxNorm

DRUG BANK

DB00442

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

SMS_ID

100000089463

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

FDA UNII

5968Y6H45M

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

WIKIPEDIA

ENTECAVIR

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

PUBCHEM

135526609

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

DAILYMED

5968Y6H45M

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

LACTMED

Entecavir

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

DRUG CENTRAL

1019

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

MESH

C413685

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

EVMPD

SUB25434

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

RS_ITEM_NUM

1235966

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

NCI_THESAURUS

C65513

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

USAN

KK-110

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

CHEBI

473990

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

MERCK INDEX

m4919

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

Merck Index

CHEBI

59902

Created by admin on Fri Dec 15 16:10:08 UTC 2023 , Edited by admin on Fri Dec 15 16:10:08 UTC 2023

PRIMARY

Related Record Type Details


					NNU2O4609D

ENTECAVIR ANHYDROUS

PARENT -> SALT/SOLVATE


					NNU2O4609D

ENTECAVIR ANHYDROUS

ANHYDROUS->SOLVATE


					6D53G0FD0Z

PLASMA PROTEIN FRACTION (HUMAN)

BINDER->LIGAND

Interaction Type:

BINDING

Amount:

Related Record Type Details


					LTP7YND4GS

2-Amino-9-[(1S,3R,4S)-4-(dimethylphenylsilyl)-2-methylene-3-[(phenylmethoxy)methyl]cyclopentyl]-1,9-dihydro-6H-purin-6-one

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					YJD4DV9LHH

8-METHOXY ENTECAVIR

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					E4WFV8XSJ4

4-DIMETHYLSILYL ENTECAVIR

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					FD1LY3K97F

ENTECAVIR 3-EPIMER

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					LNS2U38C9S

ENTECAVIR 1-EPIMER

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					Q3Y15NS7O7

ENTECAVIR 4-EPIMER

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					RQM7XS7CTB

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					S9GD7X3BFR

8-HYDROXY ENTECAVIR

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:

Related Record Type Details


					NNU2O4609D

ENTECAVIR ANHYDROUS

ACTIVE MOIETY