CHEBI:102795 - LSM-14141

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-14141
ChEBI ID CHEBI:102795
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C28H29N3O3
Net Charge 0
Average Mass 455.549
Monoisotopic Mass 455.22089
InChI InChI=1S/C28H29N3O3/c1-18(20-10-6-3-7-11-20)29-27(33)25-22(17-32)23-16-31-24(26(25)30-23)15-14-21(28(31)34)13-12-19-8-4-2-5-9-19/h2-15,18,22-23,25-26,30,32H,16-17H2,1H3,(H,29,33)/t18-,22+,23+,25-,26-/m0/s1
InChIKey FIIWKRFZHSLQJE-TXXKVYMASA-N
SMILES C[C@@H](C1=CC=CC=C1)NC(=O)[C@H]2[C@@H]([C@H]3CN4C(=CC=C(C4=O)C=CC5=CC=CC=C5)[C@@H]2N3)CO
ChEBI Ontology
Outgoing LSM-14141 (CHEBI:102795) has functional parent β-amino acid (CHEBI:33706)
LSM-14141 (CHEBI:102795) is a organonitrogen compound (CHEBI:35352)
LSM-14141 (CHEBI:102795) is a organooxygen compound (CHEBI:36963)
Manual Xref Database
LSM-14141 LINCS
View more database links