suncillin sodium (CHEBI:752689)

CHEBI:752689 - suncillin sodium

Formula	Na.C16H18N3O7S2
Net Charge	0
Average Mass	451.458
Monoisotopic Mass	451.04839
SMILES	[H][C@]12SC(C)(C)[C@H](C(=O)[O-])N1C(=O)[C@H]2NC(=O)[C@H](NS(=O)(=O)O)c1ccccc1.[Na+]
InChI	InChI=1S/C16H19N3O7S2.Na/c1-16(2)11(15(22)23)19-13(21)10(14(19)27-16)17-12(20)9(18-28(24,25)26)8-6-4-3-5-7-8;/h3-7,9-11,14,18H,1-2H3,(H,17,20)(H,22,23)(H,24,25,26);/q;+1/p-1/t9-,10-,11+,14-;/m1./s1
InChIKey	JDBMOTPJNOJOIQ-YWUHCJSESA-M

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	suncillin sodium (CHEBI:752689) is a peptide (CHEBI:16670)