ARGATROBAN

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NCATS

Details

Stereochemistry	EPIMERIC
Molecular Formula	C23H36N6O5S.H2O
Molecular Weight	526.649
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ARGATROBAN

Structure Search

SMILES

O.C[C@@H]1CCN([C@H](C1)C(O)=O)C(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)C2=C3NCC(C)CC3=CC=C2

InChI

InChIKey=AIEZTKLTLCMZIA-CZSXTPSTSA-N

InChI=1S/C23H36N6O5S.H2O/c1-14-8-10-29(18(12-14)22(31)32)21(30)17(6-4-9-26-23(24)25)28-35(33,34)19-7-3-5-16-11-15(2)13-27-20(16)19;/h3,5,7,14-15,17-18,27-28H,4,6,8-13H2,1-2H3,(H,31,32)(H4,24,25,26);1H2/t14-,15?,17+,18-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

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

Molecular Formula	C23H36N6O5S
Molecular Weight	508.634
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	3 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:25:09 UTC 2023` Edited by `admin` on `Sat Dec 16 08:25:09 UTC 2023`
Record UNII	IY90U61Z3S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ARGATROBAN

Official Name

English

ARGATROBAN MONOHYDRATE [MI]

Common Name

English

(2R,4R)-4-METHYL-1-(N (SUP 2)-((1,2,3,4-TETRAHYDRO-3-METHYL-8-QUINOLYL)SULFONYL)-L-ARGINYL)PIPECOLIC ACID, MONOHYDRATE

Common Name

English

GN-1600

Code

English

Argatroban monohydrate [WHO-DD]

Common Name

English

ARGATROBAN MONOHYDRATE

Common Name

English

ARGIPIDINE

Common Name

English

ARGATROBAN [USAN]

Common Name

English

GN1600

Code

English

2-PIPERIDINECARBOXYLIC ACID, 1-(5-((AMINOIMINOMETHYL)AMINO)-1-OXO-2-(((1,2,3,4-TETRAHYDRO-3-METHYL-8-QUINOLINYL)SULFONYL)AMINO)PENTYL)-4-METHYL-, MONOHYDRATE

Common Name

English

NOVASTAN

Brand Name

English

MCI-9038

Code

English

ARGATROBAN HYDRATE [JAN]

Common Name

English

ARGATROBAN HYDRATE

Common Name

English

ARGATROBAN [USP MONOGRAPH]

Common Name

English

MD-805

Code

English

ARGATROBAN [ORANGE BOOK]

Common Name

English

DK-7419

Code

English

ARGATROBAN [VANDF]

Common Name

English

ARGATROBAN [USP-RS]

Common Name

English

Classification Tree Code System Code

NDF-RT

N0000175980

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

NCI_THESAURUS

C263

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

NDF-RT

N0000009963

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

NDF-RT

N0000175518

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

WHO-VATC

QB01AE03

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

WHO-ATC

B01AE03

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

LOINC

68981-0

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

Code System Code Type Description

EPA CompTox

DTXSID5057888

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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LACTMED

Argatroban

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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USAN

II-67

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

PRIMARY

IUPHAR

6385

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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CAS

141396-28-3

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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DAILYMED

IY90U61Z3S

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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EVMPD

SUB48842

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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SMS_ID

100000132863

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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WIKIPEDIA

ARGATROBAN

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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FDA UNII

IY90U61Z3S

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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MESH

C031942

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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NCI_THESAURUS

C28833

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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DRUG BANK

DB00278

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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RXCUI

15202

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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RxNorm

PUBCHEM

92721

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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RS_ITEM_NUM

1042408

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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ChEMBL

CHEMBL1166

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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EVMPD

SUB05559MIG

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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MERCK INDEX

m2039

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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Merck Index

DRUG CENTRAL

239

Created by admin on Sat Dec 16 08:25:09 UTC 2023 , Edited by admin on Sat Dec 16 08:25:09 UTC 2023

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ARGATROBAN ANHYDROUS

PARENT -> SALT/SOLVATE


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ARGATROBAN ANHYDROUS

ANHYDROUS->SOLVATE

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N-NITRO TETRADEHYDROARGATROBAN

IMPURITY -> PARENT

Amount:

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ARGATROBAN ANHYDROUS

ACTIVE MOIETY