BioLiP

PDB

BioLiP

PDB CCD ID:

QCS

Number of entries in BioLiP:

Chemical formula:

C4 H8 N2 O3 S

InChI:

InChI=1S/C4H8N2O3S/c5-2(3(7)8)1-10-4(6)9/h2H,1,5H2,(H2,6,9)(H,7,8)/t2-/m0/s1

InChIKey:

YOAUVDYBDJTJJP-REOHCLBHSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.7.6	C(C(C(=O)O)N)SC(=O)N
OpenEye OEToolkits 1.7.6	C([C@@H](C(=O)O)N)SC(=O)N
ACDLabs 12.01	O=C(SCC(C(=O)O)N)N
CACTVS 3.385	N[CH](CSC(N)=O)C(O)=O
CACTVS 3.385	N[C@@H](CSC(N)=O)C(O)=O

Name:

S-carbamoyl-L-cysteine

ZINC:

ZINC000002567981

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).