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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H17NO7
Molecular Weight 323.298
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-(E)-3,4-DIMETHOXYCINNAMOYL-L-ASPARTIC ACID

SMILES

COC1=CC=C(\C=C\C(=O)N[C@@H](CC(O)=O)C(O)=O)C=C1OC

InChI

InChIKey=KOUROFCZTBJFGG-RWCYGVJQSA-N
InChI=1S/C15H17NO7/c1-22-11-5-3-9(7-12(11)23-2)4-6-13(17)16-10(15(20)21)8-14(18)19/h3-7,10H,8H2,1-2H3,(H,16,17)(H,18,19)(H,20,21)/b6-4+/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H17NO7
Molecular Weight 323.298
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 Dec 16 09:41:13 UTC 2023
Edited
by admin
on Sat Dec 16 09:41:13 UTC 2023
Record UNII
XUJ68ZU3DX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(E)-3,4-DIMETHOXYCINNAMOYL-L-ASPARTIC ACID
Common Name English
L-ASPARTIC ACID, N-((2E)-3-(3,4-DIMETHOXYPHENYL)-1-OXO-2-PROPEN-1-YL)-
Common Name English
Code System Code Type Description
FDA UNII
XUJ68ZU3DX
Created by admin on Sat Dec 16 09:41:13 UTC 2023 , Edited by admin on Sat Dec 16 09:41:13 UTC 2023
PRIMARY
PUBCHEM
162623742
Created by admin on Sat Dec 16 09:41:13 UTC 2023 , Edited by admin on Sat Dec 16 09:41:13 UTC 2023
PRIMARY
CAS
1357599-82-6
Created by admin on Sat Dec 16 09:41:13 UTC 2023 , Edited by admin on Sat Dec 16 09:41:13 UTC 2023
PRIMARY
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