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Details

Stereochemistry RACEMIC
Molecular Formula C15H21NO5
Molecular Weight 295.3309
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL N-(2-(HYDROXYMETHYL)-6-METHYLPHENYL)-N-(METHOXYACETYL)-DL-ALANINE

SMILES

COCC(=O)N(C(C)C(=O)OC)C1=C(CO)C=CC=C1C

InChI

InChIKey=JRTUFKUEKGCXQP-UHFFFAOYSA-N
InChI=1S/C15H21NO5/c1-10-6-5-7-12(8-17)14(10)16(13(18)9-20-3)11(2)15(19)21-4/h5-7,11,17H,8-9H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C15H21NO5
Molecular Weight 295.3309
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 18:32:23 GMT 2025
Edited
by admin
on Tue Apr 01 18:32:23 GMT 2025
Record UNII
Z294332IRV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL N-(2-(HYDROXYMETHYL)-6-METHYLPHENYL)-N-(METHOXYACETYL)-DL-ALANINE
Systematic Name English
DL-ALANINE, N-(2-(HYDROXYMETHYL)-6-METHYLPHENYL)-N-(METHOXYACETYL)-, METHYL ESTER
Preferred Name English
Code System Code Type Description
PUBCHEM
20055269
Created by admin on Tue Apr 01 18:32:23 GMT 2025 , Edited by admin on Tue Apr 01 18:32:23 GMT 2025
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FDA UNII
Z294332IRV
Created by admin on Tue Apr 01 18:32:23 GMT 2025 , Edited by admin on Tue Apr 01 18:32:23 GMT 2025
PRIMARY
CAS
85933-49-9
Created by admin on Tue Apr 01 18:32:23 GMT 2025 , Edited by admin on Tue Apr 01 18:32:23 GMT 2025
PRIMARY
EPA CompTox
DTXSID301349573
Created by admin on Tue Apr 01 18:32:23 GMT 2025 , Edited by admin on Tue Apr 01 18:32:23 GMT 2025
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