Molecule ID: 5280673

IUPAC Name: (Z)-2-amino-3-[(Z)-3-oxoprop-1-enyl]but-2-enedioic acid

Description: The molecule is the cis,cis-isomer of 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid. It has a role as a mouse metabolite. It is a conjugate acid of a cis,cis-2-amino-3-(3-oxoprop-1-enyl)but-2-enedioate.

SMILES: N/C(C(=O)O)=C(/C=C\C=O)C(=O)O

SELFIES: [N][/C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Branch1][Branch1][/C][=C][\C][=O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C7H7NO5/c8-5(7(12)13)4(6(10)11)2-1-3-9/h1-3H,8H2,(H,10,11)(H,12,13)/b2-1-,5-4-

Molecular Properties:
- Polar Surface Area: 118.0 Ų
- LogP: -0.5