CABOZANTINIB S-MALATE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H24FN3O5.C4H6O5
Molecular Weight	635.5931
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CABOZANTINIB S-MALATE

Structure Search

SMILES

O[C@@H](CC(O)=O)C(O)=O.COC1=CC2=NC=CC(OC3=CC=C(NC(=O)C4(CC4)C(=O)NC5=CC=C(F)C=C5)C=C3)=C2C=C1OC

InChI

InChIKey=HFCFMRYTXDINDK-WNQIDUERSA-N

InChI=1S/C28H24FN3O5.C4H6O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18;5-2(4(8)9)1-3(6)7/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34);2,5H,1H2,(H,6,7)(H,8,9)/t;2-/m.0/s1

HIDE SMILES / InChI

Molecular Formula	C28H24FN3O5
Molecular Weight	501.5057
Charge	0
Count

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

Molecular Formula	C4H6O5
Molecular Weight	134.0874
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 `Fri Dec 15 16:26:18 UTC 2023` Edited by `admin` on `Fri Dec 15 16:26:18 UTC 2023`
Record UNII	DR7ST46X58
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CABOZANTINIB S-MALATE

Official Name

English

N-(4-((6,7-DIMETHOXYQUINOLIN-4-YL)OXY)PHENYL)-N'-(4-FLUOROPHENYL)CYCLOPROPANE-1,1-DICARBOXAMIDE MONO((2S)-2-HYDROXYBUTANEDIOATE)

Systematic Name

English

XL-184

Code

English

XL184

Code

English

BMS-907351

Code

English

CABOZANTINIB MALATE [JAN]

Common Name

English

CABOZANTINIB S-MALATE [ORANGE BOOK]

Common Name

English

CABOZANTINIB S-MALATE [USAN]

Common Name

English

CABOMETYX

Brand Name

English

BUTANEDIOIC ACID, 2-HYDROXY-, (2S)-, COMPD. WITH N-(4-((6,7-DIMETHOXY-4-QUINOLINYL)OXY)PHENYL)-N'-(4-FLUOROPHENYL)-1,1-CYCLOPROPANEDICARBOXAMIDE (1:1)

Common Name

English

Cabozantinib s-malate [WHO-DD]

Common Name

English

COMETRIQ

Brand Name

English

Classification Tree Code System Code

NCI_THESAURUS

C1967

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

EU-Orphan Drug

EU/3/08/610

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

NCI_THESAURUS

C1742

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

NCI_THESAURUS

C129825

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

Code System Code Type Description

ChEMBL

CHEMBL2105717

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

PRIMARY

CAS

1140909-48-3

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

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EVMPD

SUB176318

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

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DAILYMED

DR7ST46X58

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

PRIMARY

SMS_ID

100000162458

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

PRIMARY

CHEBI

72319

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

PRIMARY

CHEBI

72317

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

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PUBCHEM

25102846

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

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NCI_THESAURUS

C97938

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

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EPA CompTox

DTXSID60915949

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

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RXCUI

1363267

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

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RxNorm

DRUG BANK

DBSALT001762

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

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FDA UNII

DR7ST46X58

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

PRIMARY

USAN

WW-155

Created by admin on Fri Dec 15 16:26:18 UTC 2023 , Edited by admin on Fri Dec 15 16:26:18 UTC 2023

PRIMARY

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