DOLUTEGRAVIR SODIUM

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H18F2N3O5.Na
Molecular Weight	441.3606
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DOLUTEGRAVIR SODIUM

Structure Search

SMILES

[Na+].[H][C@]12CN3C=C(C(=O)NCC4=CC=C(F)C=C4F)C(=O)C([O-])=C3C(=O)N1[C@H](C)CCO2

InChI

InChIKey=UGWJRRXTMKRYNK-VSLILLSYSA-M

InChI=1S/C20H19F2N3O5.Na/c1-10-4-5-30-15-9-24-8-13(17(26)18(27)16(24)20(29)25(10)15)19(28)23-7-11-2-3-12(21)6-14(11)22;/h2-3,6,8,10,15,27H,4-5,7,9H2,1H3,(H,23,28);/q;+1/p-1/t10-,15+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Molecular Formula	C20H18F2N3O5
Molecular Weight	418.3708
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:45:27 UTC 2023` Edited by `admin` on `Fri Dec 15 18:45:27 UTC 2023`
Record UNII	1Q1V9V5WYQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DOLUTEGRAVIR SODIUM

Official Name

English

TRIUMEQ COMPONENT DOLUTEGRAVIR SODIUM

Brand Name

English

Dolutegravir sodium [WHO-DD]

Common Name

English

DOLUTEGRAVIR SODIUM [ORANGE BOOK]

Common Name

English

DOLUTEGRAVIR SODIUM [USAN]

Common Name

English

DOLUTEGRAVIR SODIUM [JAN]

Common Name

English

SODIUM (4R,12AS)-9-(((2,4-DIFLUOROPHENYL)METHYL)CARBAMOYL)-4-METHYL-6,8-DIOXO-3,4,6,8,12,12A-HEXAHYDRO-2H-PYRIDO(1',2':4,5)PYRAZINO(2,1-B)(1,3)OXAZIN-7-OLATE

Common Name

English

2H-PYRIDO(1',2':4,5)PYRAZINO(2,1-B)(1,3)OXAZINE-9-CARBOXAMIDE, N-((2,4-DIFLUOROPHENYL)METHYL)-3,4,6,8,12,12A-HEXAHYDRO-7-HYDROXY-4-METHYL-6,8-DIOXO-, SODIUM SALT (1:1), (4R,12AS)-

Common Name

English

DOLUTEGRAVIR SODIUM COMPONENT OF JULUCA

Brand Name

English

TIVICAY

Brand Name

English

DOVATO

Brand Name

English

DOLUTEGRAVIR SODIUM COMPONENT OF TRIUMEQ

Brand Name

English

DOLUTEGRAVIR SODIUM SALT [MI]

Common Name

English

TIVICAY PD

Brand Name

English

GSK-1349572A

Code

English

JULUCA COMPONENT DOLUTEGRAVIR SODIUM

Brand Name

English

Classification Tree Code System Code

NCI_THESAURUS

C281

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

EMA ASSESSMENT REPORTS

TIVICAY (AUTHORIZED: HIV INFECTIONS)

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

Code System Code Type Description

PUBCHEM

46216142

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

PRIMARY

FDA UNII

1Q1V9V5WYQ

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

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MERCK INDEX

m4730

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

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Merck Index

USAN

WW-51

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

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NCI_THESAURUS

C148408

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

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CHEBI

76007

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

PRIMARY

RXCUI

1433867

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

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RxNorm

EPA CompTox

DTXSID201027849

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

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ChEMBL

CHEMBL1229211

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

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SMS_ID

100000156669

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

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DRUG BANK

DBSALT000943

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

PRIMARY

CAS

1051375-19-9

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

PRIMARY

DAILYMED

1Q1V9V5WYQ

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

PRIMARY

EVMPD

SUB130591

Created by admin on Fri Dec 15 18:45:27 UTC 2023 , Edited by admin on Fri Dec 15 18:45:27 UTC 2023

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Related Record Type Details


					DKO1W9H7M1

PARENT -> SALT/SOLVATE


					0E1T06685X

DOLUTEGRAVIR SODIUM MONOHYDRATE

SOLVATE->ANHYDROUS

Related Record Type Details


					PN3N2K4NAP

DESDIFLUORO DOLUTEGRAVIR

IMPURITY -> PARENT


					QC6U8H2E29

4-DESFLUORO-6-FLUORO DOLUTEGRAVIR

IMPURITY -> PARENT


					FGD6SPP2VH

DOLUTEGRAVIR S,S-ISOMER

IMPURITY -> PARENT


					YMS8WH5LQD

(3R)-3-(7-(((2,4-DIFLUOROPHENYL)METHYL)CARBAMOYL)-9-HYDROXY-1,8-DIOXO-1,8-DIHYDRO-2H-PYRIDO(1,2-A)PYRAZIN-2-YL)BUTYL ((2,4-DIFLUOROPHENYL)METHYL)CARBAMATE

IMPURITY -> PARENT


					CT8QT9HZN8

4-FLUORO DOLUTEGRAVIR

IMPURITY -> PARENT


					XM665LD5AD

N-((2,4-DIFLUOROPHENYL)METHYL)-1,8-DIHYDRO-9-HYDROXY-2-((1R)-3-HYDROXY-1-METHYLPROPYL)-1,8-DIOXO-2H-PYRIDO(1,2-A)PYRAZINE-7-CARBOXAMIDE

IMPURITY -> PARENT

Amount:


					29LH9LED64

4-DEFLUORO DOLUTEGRAVIR

IMPURITY -> PARENT


					KA8ZEA9QPD

4-EPI-DOLUTEGRAVIR

IMPURITY -> PARENT


					SJ4GZ8739L

(4R,12AS)-7-(BENZYLOXY)-N-(2,4-DIFLUOROBENZYL)-4-METHYL-6,8-DIOXO-3,4,6,8,12,12A-HEXAHYDRO-2H-PYRIDO(1',2':4,5)PYRAZINO(2,1-B)(1,3)OXAZINE-9-CARBOXAMIDE

IMPURITY -> PARENT


					S3BN9Q9EHW

DOLUTEGRAVIR S,R ISOMER

IMPURITY -> PARENT

Related Record Type Details


					DKO1W9H7M1

ACTIVE MOIETY