SAXAGLIPTIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H25N3O2.H2O
Molecular Weight	333.4253
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SAXAGLIPTIN

Structure Search

SMILES

O.[H][C@@]12C[C@]1([H])N([C@@H](C2)C#N)C(=O)[C@@H](N)C34CC5CC(CC(O)(C5)C3)C4

InChI

InChIKey=AFNTWHMDBNQQPX-NHKADLRUSA-N

InChI=1S/C18H25N3O2.H2O/c19-8-13-2-12-3-14(12)21(13)16(22)15(20)17-4-10-1-11(5-17)7-18(23,6-10)9-17;/h10-15,23H,1-7,9,20H2;1H2/t10?,11?,12-,13+,14+,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	C18H25N3O2
Molecular Weight	315.41
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	4 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:04:23 UTC 2023` Edited by `admin` on `Fri Dec 15 16:04:23 UTC 2023`
Record UNII	9GB927LAJW
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

SAXAGLIPTIN

Official Name

English

SAXAGLIPTIN MONOHYDRATE

Preferred Name

English

BMS-477118-11

Code

English

SAXAGLIPTIN HYDRATE

Common Name

English

SAXAGLIPTIN [USAN]

Common Name

English

(1S,3S,5S)-2-((2S)-AMINO(3-HYDROXYTRICYCLO(3.3.1.1(SUP 3,7))DEC-1-YL)ACETYL)2-AZABICYCLO(3.1.0)HEXANE-3-CARBONITRILE MONOHYDRATE

Systematic Name

English

QTERNMET COMPONENT SAXAGLIPTIN

Brand Name

English

SAXAGLIPTIN MONOHYDRATE [MI]

Common Name

English

SAXAGLIPTIN [MART.]

Common Name

English

Saxagliptin monohydrate [WHO-DD]

Common Name

English

NSC-760407

Code

English

SAXAGLIPTIN [VANDF]

Common Name

English

SAXAGLIPTIN HYDRATE [JAN]

Common Name

English

SAXAGLIPTIN COMPONENT OF QTERNMET

Brand Name

English

2-AZABICYCLO(3.1.0)HEXANE-3-CARBONITRILE, 2-((2S)-2-AMINO-2-(3-HYDROXYTRICYCLO(3.3.1.1(SUP 3,7))DEC-1-YL)ACETYL)-, HYDRATE (1:1), (1S,3S,5S)-

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C98086

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

WHO-ATC

A10BD25

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

WHO-VATC

QA10BH03

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

LIVERTOX

NBK548688

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

WHO-ATC

A10BD10

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

WHO-ATC

A10BD21

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

WHO-ATC

A10BH03

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

WHO-VATC

QA10BD10

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

Code System Code Type Description

LACTMED

Saxagliptin

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

WIKIPEDIA

SAXAGLIPTIN

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

NCI_THESAURUS

C75983

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

EVMPD

SUB184493

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

DRUG CENTRAL

4114

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

MESH

C502994

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

RXCUI

857974

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

RxNorm

FDA UNII

9GB927LAJW

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

USAN

UU-57

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

CHEBI

71271

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

SMS_ID

100000170516

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

IUPHAR

6316

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

MERCK INDEX

m9795

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

Merck Index

DAILYMED

9GB927LAJW

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

CAS

945667-22-1

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

NSC

760407

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

ChEMBL

CHEMBL385517

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

DRUG BANK

DB06335

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

EPA CompTox

DTXSID80915446

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

CHEBI

71272

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

PUBCHEM

53297473

Created by admin on Fri Dec 15 16:04:23 UTC 2023 , Edited by admin on Fri Dec 15 16:04:23 UTC 2023

PRIMARY

Related Record Type Details


					8I7IO46IVQ

SAXAGLIPTIN ANHYDROUS

ANHYDROUS->SOLVATE


					8I7IO46IVQ

SAXAGLIPTIN ANHYDROUS

PARENT -> SALT/SOLVATE

Related Record Type Details


					8I7IO46IVQ

SAXAGLIPTIN ANHYDROUS

ACTIVE MOIETY