COVPDB

Ligand

Ligand Name: N-Formyl 7-Aminocephalosporanic Acid
Ligand Type: non-polymer
Ligand ID: COVPDB153	PubChem: 12764266
Synonym(s): schembl9781628 chembl1615828 zinc39281725 3-acetoxymethyl-7beta-formamidoceph-3-em-4-carboxylic acid 7beta-formamido-3-acetoxymethylceph-3-em-4-carboxylic acid (6r,7r)-3-acetoxymethyl-7-formamidoceph-3-em-4-carboxylic acid 3-acetyloxymethyl-7beta-formylamino-ceph-3-em-4-carboxylic acid (7r)-3-(acetoxymethyl)-7-(formylamino)cepham-3-ene-4-carboxylic acid (6r,7r)-3-(acetyloxymethyl)-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid show 8 synonym(s)
DrugBank: -	ChEMBL: CHEMBL1615828
Canonical SMILES: CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC=O)C2=O)C(O)=O
Standard InChI: InChI=1S/C11H12N2O6S/c1-5(15)19-2-6-3-20-10-7(12-4-14)9(16)13(10)8(6)11(17)18/h4,7,10H,2-3H2,1H3,(H,12,14)(H,17,18)/t7-,10-/m1/s1
Molecular Formula: C11H12N2O6S	Mol. Weight: 300.0416	logP: -1.0821
HBD: 2	HBA: 6
#Rotatable Bonds: 5	TPSA: 113.01