Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L9XN6C
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| Ligand Name |
(2r)-N-[(2s,3r)-1-(1,3-Benzodioxol-5-Yl)-4-{[(4's)-6'-(2,2-Dimethylpropyl)-3',4'-Dihydrospiro[cyclobutane-1,2'-Pyrano[2,3-B]pyridin]-4'-Yl]amino}-3-Hydroxybutan-2-Yl]-2-Methoxypropanamide
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| Synonyms |
CHEMBL2181880; (2r)-N-[(2s,3r)-1-(1,3-Benzodioxol-5-Yl)-4-{[(4's)-6'-(2,2-Dimethylpropyl)-3',4'-Dihydrospiro[cyclobutane-1,2'-Pyrano[2,3-B]pyridin]-4'-Yl]amino}-3-Hydroxybutan-2-Yl]-2-Methoxypropanamide; BDBM50397678; Q27451161; 0KN
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| Structure |
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Download2D MOL |
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| Formula |
C31H43N3O6
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| Canonical SMILES |
CC(C(=O)NC(CC1=CC2=C(C=C1)OCO2)C(CNC3CC4(CCC4)OC5=C3C=C(C=N5)CC(C)(C)C)O)OC
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| InChI |
1S/C31H43N3O6/c1-19(37-5)28(36)34-23(12-20-7-8-26-27(13-20)39-18-38-26)25(35)17-32-24-15-31(9-6-10-31)40-29-22(24)11-21(16-33-29)14-30(2,3)4/h7-8,11,13,16,19,23-25,32,35H,6,9-10,12,14-15,17-18H2,1-5H3,(H,34,36)/t19-,23+,24+,25-/m1/s1
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| InChIKey |
OMMVFRZSBCRMQD-LJYZBVLISA-N
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| PubChem Compound ID | ||||
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