ALAMIFOVIR METABOLITE 602076

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H18N5O5PS
Molecular Weight	411.373
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ALAMIFOVIR METABOLITE 602076

Structure Search

SMILES

COC1=CC=C(SC2=C3N=CN(CCOCP(O)(O)=O)C3=NC(N)=N2)C=C1

InChI

InChIKey=MDFHMUJOSKTPIX-UHFFFAOYSA-N

InChI=1S/C15H18N5O5PS/c1-24-10-2-4-11(5-3-10)27-14-12-13(18-15(16)19-14)20(8-17-12)6-7-25-9-26(21,22)23/h2-5,8H,6-7,9H2,1H3,(H2,16,18,19)(H2,21,22,23)

HIDE SMILES / InChI

Molecular Formula	C15H18N5O5PS
Molecular Weight	411.373
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:47:42 GMT 2023` Edited by `admin` on `Sat Dec 16 19:47:42 GMT 2023`
Record UNII	PP7UAP8WGY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALAMIFOVIR METABOLITE 602076

Common Name

English

LY-602076

Code

English

Phosphonic acid, [[2-[2-amino-6-[(4-methoxyphenyl)thio]-9H-purin-9-yl]ethoxy]methyl]-

Systematic Name

English

P-[[2-[2-Amino-6-[(4-methoxyphenyl)thio]-9H-purin-9-yl]ethoxy]methyl]phosphonic acid

Systematic Name

English

Phosphonic acid, P-[[2-[2-amino-6-[(4-methoxyphenyl)thio]-9H-purin-9-yl]ethoxy]methyl]-

Systematic Name

English

LY602076

Code

English

Code System Code Type Description

FDA UNII

PP7UAP8WGY

Created by admin on Sat Dec 16 19:47:43 GMT 2023 , Edited by admin on Sat Dec 16 19:47:43 GMT 2023

PRIMARY

PUBCHEM

10112275

Created by admin on Sat Dec 16 19:47:43 GMT 2023 , Edited by admin on Sat Dec 16 19:47:43 GMT 2023

PRIMARY

CAS

444889-02-5

Created by admin on Sat Dec 16 19:47:43 GMT 2023 , Edited by admin on Sat Dec 16 19:47:43 GMT 2023

PRIMARY

Related Record Type Details


					0N739K2A8A

ALAMIFOVIR

PARENT -> METABOLITE

Amount: