CHEBI:149827 - CID 3191469

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name CID 3191469
ChEBI ID CHEBI:149827
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C30H32N6O5
Net Charge 0
Average Mass 556.623
Monoisotopic Mass 556.24342
InChI InChI=1S/C30H32N6O5/c1-20(37)32-22-11-13-23(14-12-22)36(28(38)19-35-27-8-4-3-7-26(27)33-34-35)29(21-9-15-24(40-2)16-10-21)30(39)31-18-25-6-5-17-41-25/h3-4,7-16,25,29H,5-6,17-19H2,1-2H3,(H,31,39)(H,32,37)
InChIKey KMZDAUWGOMFZCP-UHFFFAOYSA-N
SMILES O=C(N(C(C1=CC=C(OC)C=C1)C(=O)NCC2OCCC2)C3=CC=C(NC(=O)C)C=C3)CN4N=NC=5C4=CC=CC5
Roles Classification
Biological Role(s): anticoronaviral agent
Any antiviral agent which inhibits the activity of coronaviruses.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing CID 3191469 (CHEBI:149827) has role anticoronaviral agent (CHEBI:149553)
CID 3191469 (CHEBI:149827) is a acetamides (CHEBI:22160)
CID 3191469 (CHEBI:149827) is a anilide (CHEBI:13248)
General Comment
2020-05-22 anti-coronaviral activity data of this compound obtained from ChEMBL