4-[(2S)-2-Hydroxy-3-[[2-[(4-morpholinylcarbonyl)amino]ethyl]amino]propoxy]benzenepropanoic acid

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H29N3O6
Molecular Weight	395.4501
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-[(2S)-2-Hydroxy-3-[[2-[(4-morpholinylcarbonyl)amino]ethyl]amino]propoxy]benzenepropanoic acid

Structure Search

SMILES

O[C@@H](CNCCNC(=O)N1CCOCC1)COC2=CC=C(CCC(O)=O)C=C2

InChI

InChIKey=VZVQHRFHVTZVSV-INIZCTEOSA-N

InChI=1S/C19H29N3O6/c23-16(13-20-7-8-21-19(26)22-9-11-27-12-10-22)14-28-17-4-1-15(2-5-17)3-6-18(24)25/h1-2,4-5,16,20,23H,3,6-14H2,(H,21,26)(H,24,25)/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H29N3O6
Molecular Weight	395.4501
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 `Wed Apr 02 15:08:36 GMT 2025` Edited by `admin` on `Wed Apr 02 15:08:36 GMT 2025`
Record UNII	57ZE55RV6R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-[(2S)-2-Hydroxy-3-[[2-[(4-morpholinylcarbonyl)amino]ethyl]amino]propoxy]benzenepropanoic acid

Systematic Name

English

Benzenepropanoic acid, 4-[(2S)-2-hydroxy-3-[[2-[(4-morpholinylcarbonyl)amino]ethyl]amino]propoxy]-

Preferred Name

English

Code System Code Type Description

PUBCHEM

102064331

Created by admin on Wed Apr 02 15:08:36 GMT 2025 , Edited by admin on Wed Apr 02 15:08:36 GMT 2025

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FDA UNII

57ZE55RV6R

Created by admin on Wed Apr 02 15:08:36 GMT 2025 , Edited by admin on Wed Apr 02 15:08:36 GMT 2025

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CAS

190601-22-0

Created by admin on Wed Apr 02 15:08:36 GMT 2025 , Edited by admin on Wed Apr 02 15:08:36 GMT 2025

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EPA CompTox

DTXSID701117304

Created by admin on Wed Apr 02 15:08:36 GMT 2025 , Edited by admin on Wed Apr 02 15:08:36 GMT 2025

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