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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H13NO6
Molecular Weight 279.2459
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-COUMAROYL-L-ASPARTIC ACID

SMILES

c1cc(ccc1/C(/[H])=C(\[H])/C(=N[C@@]([H])(CC(=O)O)C(=O)O)O)O

InChI

InChIKey=FKBRNPNAUOXZMQ-YVGDHZEHSA-N
InChI=1S/C13H13NO6/c15-9-4-1-8(2-5-9)3-6-11(16)14-10(13(19)20)7-12(17)18/h1-6,10,15H,7H2,(H,14,16)(H,17,18)(H,19,20)/b6-3+/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H13NO6
Molecular Weight 279.2459
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 13:29:07 UTC 2021
Edited
by admin
on Sat Jun 26 13:29:07 UTC 2021
Record UNII
AJE3N72YTX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-COUMAROYL-L-ASPARTIC ACID
Common Name English
N-(E)-P-COUMAROYL-L-ASPARTIC ACID
Common Name English
L-ASPARTIC ACID, N-(3-(4-HYDROXYPHENYL)-1-OXO-2-PROPENYL)-, (E)-
Common Name English
L-ASPARTIC ACID, N-((2E)-3-(4-HYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)-
Systematic Name English
Code System Code Type Description
FDA UNII
AJE3N72YTX
Created by admin on Sat Jun 26 13:29:07 UTC 2021 , Edited by admin on Sat Jun 26 13:29:07 UTC 2021
PRIMARY
CAS
151435-24-4
Created by admin on Sat Jun 26 13:29:07 UTC 2021 , Edited by admin on Sat Jun 26 13:29:07 UTC 2021
PRIMARY
PUBCHEM
68537088
Created by admin on Sat Jun 26 13:29:07 UTC 2021 , Edited by admin on Sat Jun 26 13:29:07 UTC 2021
PRIMARY
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