CHEBI:112775 - LSM-24185

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ChEBI Name LSM-24185
ChEBI ID CHEBI:112775
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C26H26N2O5
Net Charge 0
Average Mass 446.496
Monoisotopic Mass 446.18417
InChI InChI=1S/C26H26N2O5/c29-24-7-3-6-22-17-10-16(13-28(22)24)12-27(14-17)25(30)15-32-18-8-9-20-19-4-1-2-5-21(19)26(31)33-23(20)11-18/h3,6-9,11,16-17H,1-2,4-5,10,12-15H2/t16-,17+/m1/s1
InChIKey HKBYEHNTKISRIN-SJORKVTESA-N
SMILES C1CCC2=C(C1)C3=C(C=C(C=C3)OCC(=O)N4C[C@H]5C[C@@H](C4)C6=CC=CC(=O)N6C5)OC2=O
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-24185 (CHEBI:112775) is a alkaloid (CHEBI:22315)
Manual Xref Database
LSM-24185 LINCS
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