BioLiP

PDB

BioLiP

PDB CCD ID:

CPC

Number of entries in BioLiP:

Chemical formula:

C6 H11 N O2

InChI:

InChI=1S/C6H11NO2/c1-4-3-6(4,7-2)5(8)9/h4,7H,3H2,1-2H3,(H,8,9)/t4-,6-/m0/s1

InChIKey:

DYSUVIPLCIOCKL-NJGYIYPDSA-N

SMILES:

Software	SMILES
CACTVS 3.341	CN[C]1(C[CH]1C)C(O)=O
ACDLabs 10.04	O=C(O)C1(NC)CC1C
OpenEye OEToolkits 1.5.0	C[C@H]1C[C@]1(C(=O)O)NC
CACTVS 3.341	CN[C@]1(C[C@@H]1C)C(O)=O
OpenEye OEToolkits 1.5.0	CC1CC1(C(=O)O)NC

Name:

2-METHYL-1-METHYLAMINO-CYCLOPROPANE CARBOXYLIC ACID

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).