CHEBI:102705 - LSM-14052

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-14052
ChEBI ID CHEBI:102705
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C32H42N4O4
Net Charge 0
Average Mass 546.701
Monoisotopic Mass 546.32061
InChI InChI=1S/C32H42N4O4/c1-21-17-36(22(2)19-37)32(39)30-29(25-13-8-9-14-26(25)35(30)5)24-12-7-6-11-23(24)20-40-28(21)18-34(4)31(38)27-15-10-16-33(27)3/h6-9,11-14,21-22,27-28,37H,10,15-20H2,1-5H3/t21-,22+,27+,28-/m1/s1
InChIKey QNPXTRYBNJAKIP-BYXJMBFLSA-N
SMILES C[C@@H]1CN(C(=O)C2=C(C3=CC=CC=C3CO[C@@H]1CN(C)C(=O)[C@@H]4CCCN4C)C5=CC=CC=C5N2C)[C@@H](C)CO
ChEBI Ontology
Outgoing LSM-14052 (CHEBI:102705) is a proline derivative (CHEBI:26273)
Manual Xref Database
LSM-14052 LINCS
View more database links