TEMOZOLOMIDE ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H5N5O3
Molecular Weight	195.1356
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1N=NC2=C(N=CN2C1=O)C(O)=O

InChI

InChIKey=VVTMIOYTNALQAW-UHFFFAOYSA-N

InChI=1S/C6H5N5O3/c1-10-6(14)11-2-7-3(5(12)13)4(11)8-9-10/h2H,1H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C6H5N5O3
Molecular Weight	195.1356
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 08:35:40 UTC 2023` Edited by `admin` on `Sat Dec 16 08:35:40 UTC 2023`
Record UNII	M35A7FW55W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TEMOZOLOMIDE ACID

Common Name

English

TEMOZOLOMIDE-8-CARBOXYLIC ACID

Systematic Name

English

IMIDAZO(5,1-D)-1,2,3,5-TETRAZINE-8-CARBOXYLIC ACID, 3,4-DIHYDRO-3-METHYL-4-OXO-

Systematic Name

English

3-METHYL-4-OXO-3,4-DIHYDROIMIDAZO(5,1-D)(1,2,3,5)TETRAZINE-8-CARBOXYLIC ACID

Systematic Name

English

TEMOZOLOMIDE IMPURITY, TEMOZOLOMIDE ACID- [USP IMPURITY]

Common Name

English

TEMOZOLOMIDE IMPURITY B [EP IMPURITY]

Common Name

English

Code System Code Type Description

CAS

113942-30-6

Created by admin on Sat Dec 16 08:35:40 UTC 2023 , Edited by admin on Sat Dec 16 08:35:40 UTC 2023

PRIMARY

PUBCHEM

11830328

Created by admin on Sat Dec 16 08:35:40 UTC 2023 , Edited by admin on Sat Dec 16 08:35:40 UTC 2023

PRIMARY

FDA UNII

M35A7FW55W

Created by admin on Sat Dec 16 08:35:40 UTC 2023 , Edited by admin on Sat Dec 16 08:35:40 UTC 2023

PRIMARY

EPA CompTox

DTXSID40150614

Created by admin on Sat Dec 16 08:35:40 UTC 2023 , Edited by admin on Sat Dec 16 08:35:40 UTC 2023

PRIMARY

Related Record Type Details


					YF1K15M17Y

TEMOZOLOMIDE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount: