CHEBI:101714 - LSM-13076

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ChEBI Name LSM-13076
ChEBI ID CHEBI:101714
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C30H37N3O3
Net Charge 0
Average Mass 487.634
Monoisotopic Mass 487.28349
InChI InChI=1S/C30H37N3O3/c1-2-15-32-26-18-33-25(13-12-23(29(33)35)21-9-4-3-5-10-21)28(32)27(24(26)19-34)30(36)31-16-14-20-8-6-7-11-22(20)17-31/h6-9,11-13,24,26-28,34H,2-5,10,14-19H2,1H3/t24-,26-,27+,28+/m0/s1
InChIKey KTCZPISMGPPISS-GDWZEYGFSA-N
SMILES CCCN1[C@H]2CN3C(=CC=C(C3=O)C4=CCCCC4)[C@@H]1[C@@H]([C@H]2CO)C(=O)N5CCC6=CC=CC=C6C5
ChEBI Ontology
Outgoing LSM-13076 (CHEBI:101714) is a isoquinolines (CHEBI:24922)
Manual Xref Database
LSM-13076 LINCS
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