CHEBI:101975 - LSM-13336

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ChEBI Name LSM-13336
ChEBI ID CHEBI:101975
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C27H36N4O4
Net Charge 0
Average Mass 480.600
Monoisotopic Mass 480.27366
InChI InChI=1S/C27H36N4O4/c1-2-30-23-17-31-22(10-9-20(27(31)34)19-7-4-3-5-8-19)25(30)24(21(23)18-32)26(33)28-11-6-12-29-13-15-35-16-14-29/h3-5,7-10,21,23-25,32H,2,6,11-18H2,1H3,(H,28,33)/t21-,23-,24+,25+/m1/s1
InChIKey VXNMHMGWLBIVRP-VGCGRUFVSA-N
SMILES CCN1[C@@H]2CN3C(=CC=C(C3=O)C4=CC=CC=C4)[C@H]1[C@H]([C@@H]2CO)C(=O)NCCCN5CCOCC5
ChEBI Ontology
Outgoing LSM-13336 (CHEBI:101975) is a phenylpyridine (CHEBI:38193)
Manual Xref Database
LSM-13336 LINCS
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