PREGABALIN ARENACARBIL

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H27NO6
Molecular Weight	317.378
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PREGABALIN ARENACARBIL

Structure Search

SMILES

CC(C)C[C@H](CNC(=O)O[C@H](C)OC(=O)C(C)C)CC(O)=O

InChI

InChIKey=YDHZNJWFIYERIF-NEPJUHHUSA-N

InChI=1S/C15H27NO6/c1-9(2)6-12(7-13(17)18)8-16-15(20)22-11(5)21-14(19)10(3)4/h9-12H,6-8H2,1-5H3,(H,16,20)(H,17,18)/t11-,12+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H27NO6
Molecular Weight	317.378
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:08:33 UTC 2023` Edited by `admin` on `Sat Dec 16 10:08:33 UTC 2023`
Record UNII	JNY093NZ79
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PREGABALIN ARENACARBIL

Official Name

English

pregabalin arenacarbil [INN]

Common Name

English

HEXANOIC ACID, 5-METHYL-3-(((((1R)-1-(2-METHYL-1-OXOPROPOXY)ETHOXY)CARBONYL)AMINO)METHYL)-, (3S)-

Systematic Name

English

(3S)-5-METHYL-3-(((((1R)-1-(2-METHYL-1-OXOPROPOXY)ETHOXY)CARBONYL)AMINO)METHYL)HEXANOIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

JNY093NZ79

Created by admin on Sat Dec 16 10:08:33 UTC 2023 , Edited by admin on Sat Dec 16 10:08:33 UTC 2023

PRIMARY

CAS

1174748-30-1

Created by admin on Sat Dec 16 10:08:33 UTC 2023 , Edited by admin on Sat Dec 16 10:08:33 UTC 2023

PRIMARY

SMS_ID

300000018840

Created by admin on Sat Dec 16 10:08:33 UTC 2023 , Edited by admin on Sat Dec 16 10:08:33 UTC 2023

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PUBCHEM

44138069

Created by admin on Sat Dec 16 10:08:33 UTC 2023 , Edited by admin on Sat Dec 16 10:08:33 UTC 2023

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NCI_THESAURUS

C175848

Created by admin on Sat Dec 16 10:08:33 UTC 2023 , Edited by admin on Sat Dec 16 10:08:33 UTC 2023

PRIMARY

INN

11118

Created by admin on Sat Dec 16 10:08:33 UTC 2023 , Edited by admin on Sat Dec 16 10:08:33 UTC 2023

PRIMARY

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