BioLiP

PDB

BioLiP

PDB CCD ID:

ASA

Number of entries in BioLiP:

Chemical formula:

C4 H7 N O3

InChI:

InChI=1S/C4H7NO3/c5-3(2-6)1-4(7)8/h2-3H,1,5H2,(H,7,8)/t3-/m0/s1

InChIKey:

CGJJPOYORMGCGE-VKHMYHEASA-N

SMILES:

Software	SMILES
CACTVS 3.370	N[CH](CC(O)=O)C=O
CACTVS 3.370	N[C@@H](CC(O)=O)C=O
ACDLabs 12.01	O=CC(N)CC(=O)O
OpenEye OEToolkits 1.7.0	C(C(C=O)N)C(=O)O
OpenEye OEToolkits 1.7.0	C([C@@H](C=O)N)C(=O)O

Name:

ASPARTIC ALDEHYDE

Reference:

Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).

Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).