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CHEBI:756769 - bli-489

Default Structure
ChEBI IDCHEBI:756769
ChEBI Namebli-489
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaNa.C13H10N3O4S
Net Charge0
Average Mass327.297
Monoisotopic Mass327.02897
SMILES[H][C@]12SC=C(C(=O)[O-])N1C(=O)/C2=C/c1cn2c(n1)COCC2.[Na+]
InChIInChI=1S/C13H11N3O4S.Na/c17-11-8(12-16(11)9(6-21-12)13(18)19)3-7-4-15-1-2-20-5-10(15)14-7;/h3-4,6,12H,1-2,5H2,(H,18,19);/q;+1/p-1/b8-3-;/t12-;/m1./s1
InChIKeyRFSWVJXWZXQOSW-ZDFSRXSCSA-M
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
bli-489 (CHEBI:756769) is a α-amino acid (CHEBI:33704)
Synonyms  Source
Bli-489ChEMBL
BLI 489ChEMBL