Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LAQ7W2
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| Ligand Name |
(3S,14R,16S)-16-[(1R)-1-hydroxy-2-{[3-(1-methylethyl)benzyl]amino}ethyl]-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5-dione
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| Synonyms |
CHEMBL564010; (3S,14R,16S)-16-[(1R)-1-hydroxy-2-{[3-(1-methylethyl)benzyl]amino}ethyl]-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5-dione; BAV; SCHEMBL3196431; BDBM50294219; Q27458291; (3S,14R,16S)-16-((R)-1-hydroxy-2-(3-isopropylbenzylamino)ethyl)-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5-dione
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| Structure |
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Download2D MOL |
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| Formula |
C29H49N3O3
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| Canonical SMILES |
CC1CCCCCCCCC(=O)N(C(C(=O)NC(C1)C(CNCC2=CC(=CC=C2)C(C)C)O)C)C
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| InChI |
1S/C29H49N3O3/c1-21(2)25-15-12-14-24(18-25)19-30-20-27(33)26-17-22(3)13-10-8-6-7-9-11-16-28(34)32(5)23(4)29(35)31-26/h12,14-15,18,21-23,26-27,30,33H,6-11,13,16-17,19-20H2,1-5H3,(H,31,35)/t22-,23+,26+,27-/m1/s1
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| InChIKey |
LHBBUGLYVFZUTH-GXVHRJHYSA-N
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| PubChem Compound ID | ||||
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