TRIMETREXATE GLUCURONATE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H23N5O3.C6H10O7
Molecular Weight	563.557
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TRIMETREXATE GLUCURONATE

Structure Search

SMILES

O[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)C(O)=O.COC1=CC(NCC2=C(C)C3=C(N)N=C(N)N=C3C=C2)=CC(OC)=C1OC

InChI

InChIKey=ZCJXQWYMBJYJNB-LRDBBFHQSA-N

InChI=1S/C19H23N5O3.C6H10O7/c1-10-11(5-6-13-16(10)18(20)24-19(21)23-13)9-22-12-7-14(25-2)17(27-4)15(8-12)26-3;7-1-2(8)3(9)4(10)5(11)6(12)13/h5-8,22H,9H2,1-4H3,(H4,20,21,23,24);1-5,8-11H,(H,12,13)/t;2-,3+,4-,5-/m.0/s1

HIDE SMILES / InChI

Molecular Formula	C6H10O7
Molecular Weight	194.1394
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C19H23N5O3
Molecular Weight	369.4176
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 `Fri Dec 15 15:31:02 UTC 2023` Edited by `admin` on `Fri Dec 15 15:31:02 UTC 2023`
Record UNII	L137U4A79K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TRIMETREXATE GLUCURONATE

Official Name

English

2,4-QUINAZOLINEDIAMINE, 5-METHYL-6-(((3,4,5-TRIMETHOXYPHENYL)AMINO)METHYL)-, MONO-D-GLUCURONATE

Common Name

English

TRIMETREXATE GLUCURONATE [MART.]

Common Name

English

Trimetrexate glucuronate [WHO-DD]

Common Name

English

TRIMETREXATE GLUCURONATE [ORANGE BOOK]

Common Name

English

TRIMETREXATE D-GLUCURONATE

Common Name

English

CI-898

Code

English

NEUTREXIN

Brand Name

English

D-GLUCURONIC ACID, COMPD. WITH 5-METHYL-6-(((3,4,5-TRIMETHOXYPHENYL)AMINO)METHYL)-2,4-QUINAZOLINEDIAMINE (1:1)

Systematic Name

English

NSC-352122

Code

English

2,4-DIAMINO-5-METHYL-6-((3,4,5-TRIMETHOXYANILINO)METHYL)QUINAZOLINE MONO-D-GLUCURONATE

Common Name

English

TRIMETREXATE GLUCURONATE [VANDF]

Common Name

English

TRIMETREXATE GLUCURONATE [USAN]

Common Name

English

TRIMETREXATE D-GLUCURONATE [MI]

Common Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

14286

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

FDA ORPHAN DRUG

14686

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

FDA ORPHAN DRUG

8385

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

NCI_THESAURUS

C2153

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

Code System Code Type Description

EPA CompTox

DTXSID90273968

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

PRIMARY

PUBCHEM

54949

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

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NCI_THESAURUS

C1265

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

PRIMARY

RXCUI

38725

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

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RxNorm

NSC

352122

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

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CAS

82952-64-5

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

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MERCK INDEX

m11163

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

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Merck Index

EVMPD

SUB04976MIG

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

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SMS_ID

100000084647

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

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FDA UNII

L137U4A79K

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

PRIMARY

DRUG BANK

DBSALT002433

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

PRIMARY

ChEMBL

CHEMBL119

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

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MESH

C056321

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

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USAN

AA-34

Created by admin on Fri Dec 15 15:31:02 UTC 2023 , Edited by admin on Fri Dec 15 15:31:02 UTC 2023

PRIMARY

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