CHEBI:114652 - LSM-26114

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-26114
ChEBI ID CHEBI:114652
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C24H25NO4
Net Charge 0
Average Mass 391.461
Monoisotopic Mass 391.17836
InChI InChI=1S/C24H25NO4/c1-15-20(23(27)29-14-16-8-5-4-6-9-16)22(19-10-7-11-28-19)21-17(25-15)12-24(2,3)13-18(21)26/h4-11,21-22H,12-14H2,1-3H3
InChIKey ADVVHPUGRWNUCK-UHFFFAOYSA-N
SMILES CC1=C(C(C2C(=N1)CC(CC2=O)(C)C)C3=CC=CO3)C(=O)OCC4=CC=CC=C4
ChEBI Ontology
Outgoing LSM-26114 (CHEBI:114652) has functional parent benzyl alcohol (CHEBI:17987)
LSM-26114 (CHEBI:114652) is a carboxylic ester (CHEBI:33308)
Manual Xref Database
LSM-26114 LINCS
View more database links