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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H15NO7
Molecular Weight 309.2714
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-((2E)-3-(3-HYDROXY-4-METHOXYPHENYL)-1-OXO-2-PROPEN-1-YL)-L-ASPARTIC ACID

SMILES

COC1=CC=C(\C=C\C(=O)N[C@@H](CC(O)=O)C(O)=O)C=C1O

InChI

InChIKey=XZPKPWXSFGFVEG-SGRBOOSSSA-N
InChI=1S/C14H15NO7/c1-22-11-4-2-8(6-10(11)16)3-5-12(17)15-9(14(20)21)7-13(18)19/h2-6,9,16H,7H2,1H3,(H,15,17)(H,18,19)(H,20,21)/b5-3+/t9-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H15NO7
Molecular Weight 309.2714
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 09:41:12 GMT 2023
Edited
by admin
on Sat Dec 16 09:41:12 GMT 2023
Record UNII
EN5X3LLP34
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-((2E)-3-(3-HYDROXY-4-METHOXYPHENYL)-1-OXO-2-PROPEN-1-YL)-L-ASPARTIC ACID
Systematic Name English
N-(E)-ISOFERUOYL-L-ASPARTIC ACID
Common Name English
L-ASPARTIC ACID, N-((2E)-3-(3-HYDROXY-4-METHOXYPHENYL)-1-OXO-2-PROPEN-1-YL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
162368344
Created by admin on Sat Dec 16 09:41:12 GMT 2023 , Edited by admin on Sat Dec 16 09:41:12 GMT 2023
PRIMARY
FDA UNII
EN5X3LLP34
Created by admin on Sat Dec 16 09:41:12 GMT 2023 , Edited by admin on Sat Dec 16 09:41:12 GMT 2023
PRIMARY
CAS
1357599-81-5
Created by admin on Sat Dec 16 09:41:12 GMT 2023 , Edited by admin on Sat Dec 16 09:41:12 GMT 2023
PRIMARY
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