pirbenicillin sodium (CHEBI:752313)

CHEBI:752313 - pirbenicillin sodium

Formula	Na.C24H25N6O5S
Net Charge	0
Average Mass	532.558
Monoisotopic Mass	532.15048
SMILES	[H][C@]12SC(C)(C)[C@H](C(=O)[O-])N1C(=O)[C@H]2NC(=O)[C@H](NC(=O)CNC(=N)c1ccncc1)c1ccccc1.[Na+]
InChI	InChI=1S/C24H26N6O5S.Na/c1-24(2)18(23(34)35)30-21(33)17(22(30)36-24)29-20(32)16(13-6-4-3-5-7-13)28-15(31)12-27-19(25)14-8-10-26-11-9-14;/h3-11,16-18,22H,12H2,1-2H3,(H2,25,27)(H,28,31)(H,29,32)(H,34,35);/q;+1/p-1/t16-,17-,18+,22-;/m1./s1
InChIKey	LWRGPIPUJPCPAY-HSRLECSKSA-M

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	pirbenicillin sodium (CHEBI:752313) is a peptide (CHEBI:16670)