CHEBI:31759 - Lafutidine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Lafutidine
ChEBI ID CHEBI:31759
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formulae C22H29N3O4S
C22H29N3O4S
Net Charge 0
Average Mass 431.550
Monoisotopic Mass 431.18788
InChI InChI=1S/C22H29N3O4S/c26-21(18-30(27)17-20-7-6-14-28-20)23-9-2-5-13-29-22-15-19(8-10-24-22)16-25-11-3-1-4-12-25/h2,5-8,10,14-15H,1,3-4,9,11-13,16-18H2,(H,23,26)/b5-2-
InChIKey KMZQAVXSMUKBPD-DJWKRKHSSA-N
SMILES C1CCN(CC1)CC2=CC(=NC=C2)OC/C=C\CNC(CS(CC3=CC=CO3)=O)=O
ChEBI Ontology
Outgoing Lafutidine (CHEBI:31759) is a organic molecular entity (CHEBI:50860)
Synonyms Sources
FRG 8813 DrugCentral
FRG-8813 DrugCentral
laflutidine DrugCentral
Lafutidine KEGG COMPOUND
protecadin DrugCentral
Manual Xrefs Databases
1537 DrugCentral
D01131 KEGG DRUG
HMDB0240216 HMDB
View more database links
Registry Numbers Types Sources
118288-08-7 CAS Registry Number KEGG COMPOUND
206449-93-6 CAS Registry Number DrugCentral
Last Modified
22 February 2017