CALPEPTIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H30N2O4
Molecular Weight	362.4632
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OCC1=CC=CC=C1)C=O

InChI

InChIKey=PGGUOGKHUUUWAF-ROUUACIJSA-N

InChI=1S/C20H30N2O4/c1-4-5-11-17(13-23)21-19(24)18(12-15(2)3)22-20(25)26-14-16-9-7-6-8-10-16/h6-10,13,15,17-18H,4-5,11-12,14H2,1-3H3,(H,21,24)(H,22,25)/t17-,18-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H30N2O4
Molecular Weight	362.4632
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 `Fri Dec 15 18:07:36 UTC 2023` Edited by `admin` on `Fri Dec 15 18:07:36 UTC 2023`
Record UNII	18X9FR245W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CALPEPTIN

Common Name

English

N-CBZ-LEU-NLEU-AL

Common Name

English

BENZYLCARBONYL-LEU-NLEU-H

Common Name

English

CARBAMIC ACID, N-((1S)-1-((((1S)-1-FORMYLPENTYL)AMINO)CARBONYL)-3-METHYLBUTYL)-, PHENYLMETHYL ESTER

Systematic Name

English

Code System Code Type Description

CAS

117591-20-5

Created by admin on Fri Dec 15 18:07:36 UTC 2023 , Edited by admin on Fri Dec 15 18:07:36 UTC 2023

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FDA UNII

18X9FR245W

Created by admin on Fri Dec 15 18:07:36 UTC 2023 , Edited by admin on Fri Dec 15 18:07:36 UTC 2023

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EPA CompTox

DTXSID90922464

Created by admin on Fri Dec 15 18:07:36 UTC 2023 , Edited by admin on Fri Dec 15 18:07:36 UTC 2023

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PUBCHEM

73364

Created by admin on Fri Dec 15 18:07:36 UTC 2023 , Edited by admin on Fri Dec 15 18:07:36 UTC 2023

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Related Record Type Details


					18X9FR245W

CALPEPTIN

ACTIVE MOIETY