(1-METHYLETHYL) (8R)-5-HYDROXY-8-METHYL-9-(6-(((1-METHYLETHOXY)CARBONYL)AMINO)-9H-PURIN-9-YL)-5-OXO-2,4,7-TRIOXA-5-.LAMBDA.5-PHOSPHANONANOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H28N5O9P
Molecular Weight	489.4168
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (1-METHYLETHYL) (8R)-5-HYDROXY-8-METHYL-9-(6-(((1-METHYLETHOXY)CARBONYL)AMINO)-9H-PURIN-9-YL)-5-OXO-2,4,7-TRIOXA-5-.LAMBDA.5-PHOSPHANONANOATE

Structure Search

SMILES

CC(C)OC(=O)NC1=NC=NC2=C1N=CN2C[C@@H](C)OCP(O)(=O)OCOC(=O)OC(C)C

InChI

InChIKey=CEFDJALYGKEXAQ-CYBMUJFWSA-N

InChI=1S/C18H28N5O9P/c1-11(2)31-17(24)22-15-14-16(20-7-19-15)23(8-21-14)6-13(5)29-10-33(26,27)30-9-28-18(25)32-12(3)4/h7-8,11-13H,6,9-10H2,1-5H3,(H,26,27)(H,19,20,22,24)/t13-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H28N5O9P
Molecular Weight	489.4168
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:25:57 UTC 2023` Edited by `admin` on `Sat Dec 16 11:25:57 UTC 2023`
Record UNII	BNM443XH9I
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

(1-METHYLETHYL) (8R)-5-HYDROXY-8-METHYL-9-(6-(((1-METHYLETHOXY)CARBONYL)AMINO)-9H-PURIN-9-YL)-5-OXO-2,4,7-TRIOXA-5-.LAMBDA.5-PHOSPHANONANOATE

Systematic Name

English

TENOFOVIR DISOPROXIL FUMARATE IMPURITY E

Common Name

English

TENOFOVIR DISOPROXIL FUMARATE IMPURITY E [WHO-IP]

Common Name

English

(1-METHYLETHYL) (8R)-5-HYDROXY-8-METHYL-9-(6-(((1-METHYLETHOXY)CARBONYL)AMINO)-9H-PURIN-9-YL)-5-OXO-2,4,7-TRIOXA-5-.LAMBDA.5-PHOSPHANONANOATE [WHO-IP]

Common Name

English

2,4,7-TRIOXA-5-PHOSPHANONANOIC ACID, 5-HYDROXY-8-METHYL-9-(6-(((1-METHYLETHOXY)CARBONYL)AMINO)-9H-PURIN-9-YL)-, 1-METHYLETHYL ESTER, 5-OXIDE, (8R)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

71750819

Created by admin on Sat Dec 16 11:25:57 UTC 2023 , Edited by admin on Sat Dec 16 11:25:57 UTC 2023

PRIMARY

CAS

1244022-56-7

Created by admin on Sat Dec 16 11:25:57 UTC 2023 , Edited by admin on Sat Dec 16 11:25:57 UTC 2023

PRIMARY

FDA UNII

BNM443XH9I

Created by admin on Sat Dec 16 11:25:57 UTC 2023 , Edited by admin on Sat Dec 16 11:25:57 UTC 2023

PRIMARY

EPA CompTox

DTXSID40858143

Created by admin on Sat Dec 16 11:25:57 UTC 2023 , Edited by admin on Sat Dec 16 11:25:57 UTC 2023

PRIMARY

Related Record Type Details


					OTT9J7900I

TENOFOVIR DISOPROXIL FUMARATE

PARENT -> IMPURITY

Comments:

Amount Not Specified

Amount: