U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C13H13NO6
Molecular Weight 279.2454
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-(E)-M-COUMAROYL-L-ASPARTIC ACID

SMILES

OC(=O)C[C@H](NC(=O)\C=C\C1=CC=CC(O)=C1)C(O)=O

InChI

InChIKey=LBHTXBYXDUEHBQ-YEZKRMTDSA-N
InChI=1S/C13H13NO6/c15-9-3-1-2-8(6-9)4-5-11(16)14-10(13(19)20)7-12(17)18/h1-6,10,15H,7H2,(H,14,16)(H,17,18)(H,19,20)/b5-4+/t10-/m0/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
N-(E)-M-COUMAROYL-L-ASPARTIC ACID
Common Name English
L-ASPARTIC ACID, N-((2E)-3-(3-HYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)-
Preferred Name English
N-((2E)-3-(3-HYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)-L-ASPARTIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
145984012
Created by admin on Mon Mar 31 18:19:06 GMT 2025 , Edited by admin on Mon Mar 31 18:19:06 GMT 2025
PRIMARY
CAS
1357599-79-1
Created by admin on Mon Mar 31 18:19:06 GMT 2025 , Edited by admin on Mon Mar 31 18:19:06 GMT 2025
PRIMARY
FDA UNII
NSE5JNQ868
Created by admin on Mon Mar 31 18:19:06 GMT 2025 , Edited by admin on Mon Mar 31 18:19:06 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966