BioLiP

PDB

BioLiP

PDB CCD ID:

ORT

Number of entries in BioLiP:

Chemical formula:

C5 H11 N3 O3

InChI:

InChI=1S/C5H11N3O3/c6-3(5(10)11)1-2-4(9)8-7/h3H,1-2,6-7H2,(H,8,9)(H,10,11)/t3-/m0/s1

InChIKey:

MOFBPUBBBREDCE-VKHMYHEASA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	C(CC(=O)NN)C(C(=O)O)N
OpenEye OEToolkits 2.0.7	C(CC(=O)NN)[C@@H](C(=O)O)N
CACTVS 3.385	NNC(=O)CC[CH](N)C(O)=O
CACTVS 3.385	NNC(=O)CC[C@H](N)C(O)=O

Name:

(4~{S})-4-azanyl-5-oxidanylidene-pentanehydrazide

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).