ENTECAVIR 1-EPIMER

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C12H15N5O3
Molecular Weight	277.2792
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=QDGZDCVAUDNJFG-RNJXMRFFSA-N

InChI=1S/C12H15N5O3/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)/t6-,7+,8-/m0/s1

HIDE SMILES / InChI

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 `Sat Dec 16 15:57:18 UTC 2023` Edited by `admin` on `Sat Dec 16 15:57:18 UTC 2023`
Record UNII	LNS2U38C9S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ENTECAVIR 1-EPIMER

Common Name

English

6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(1R,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]-

Systematic Name

English

ENTECAVIR MONOHYDRATE IMPURITY A [EP IMPURITY]

Common Name

English

9-((1R,3R,4S)-4-HYDROXY-3-(HYDROXYMETHYL)-2-METHYLENECYCLOPENTYL)GUANINE

Systematic Name

English

2-Amino-1,9-dihydro-9-[(1R,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]-6H-purin-6-one

Systematic Name

English

ENTECAVIR 1-EPIMER [USP IMPURITY]

Common Name

English

Code System Code Type Description

PUBCHEM

135743573

Created by admin on Sat Dec 16 15:57:18 UTC 2023 , Edited by admin on Sat Dec 16 15:57:18 UTC 2023

PRIMARY

CAS

1367369-78-5

Created by admin on Sat Dec 16 15:57:18 UTC 2023 , Edited by admin on Sat Dec 16 15:57:18 UTC 2023

PRIMARY

FDA UNII

LNS2U38C9S

Created by admin on Sat Dec 16 15:57:18 UTC 2023 , Edited by admin on Sat Dec 16 15:57:18 UTC 2023

PRIMARY

Related Record Type Details


					5968Y6H45M

ENTECAVIR

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount: