Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LEM95R
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| Ligand Name |
(5S,8S,10R)-8-[(1R)-1-hydroxy-2-{[(5-propyl-1H-pyrazol-3-yl)methyl]amino}ethyl]-4,5,10-trimethyl-1-oxa-4,7-diazacyclohexadecane-3,6-dione
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| Synonyms |
(5S,8S,10R)-8-[(1R)-1-hydroxy-2-{[(5-propyl-1H-pyrazol-3-yl)methyl]amino}ethyl]-4,5,10-trimethyl-1-oxa-4,7-diazacyclohexadecane-3,6-dione; BACE_5; BDBM586653; E5Y
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| Structure |
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Download2D MOL |
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| Formula |
C25H45N5O4
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| Canonical SMILES |
CCCC1=NNC(=C1)CNCC(C2CC(CCCCCCOCC(=O)N(C(C(=O)N2)C)C)C)O
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| InChI |
1S/C25H45N5O4/c1-5-10-20-14-21(29-28-20)15-26-16-23(31)22-13-18(2)11-8-6-7-9-12-34-17-24(32)30(4)19(3)25(33)27-22/h14,18-19,22-23,26,31H,5-13,15-17H2,1-4H3,(H,27,33)(H,28,29)/t18-,19+,22+,23-/m1/s1
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| InChIKey |
NLWPKRWRLRUIHJ-CQIJRDABSA-N
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| PubChem Compound ID | ||||
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