CHEBI:105390 - LSM-16753

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ChEBI Name LSM-16753
ChEBI ID CHEBI:105390
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H21ClN2O5
Net Charge 0
Average Mass 440.877
Monoisotopic Mass 440.11390
InChI InChI=1S/C23H21ClN2O5/c1-12-15-6-17(24)19(27)8-20(15)31-23(30)16(12)7-22(29)25-9-13-5-14(11-25)18-3-2-4-21(28)26(18)10-13/h2-4,6,8,13-14,27H,5,7,9-11H2,1H3/t13-,14+/m1/s1
InChIKey RAXNGZMLLUDZAC-KGLIPLIRSA-N
SMILES CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)N3C[C@H]4C[C@@H](C3)C5=CC=CC(=O)N5C4
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
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ChEBI Ontology
Outgoing LSM-16753 (CHEBI:105390) is a alkaloid (CHEBI:22315)
Manual Xref Database
LSM-16753 LINCS
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