Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LL36PR
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| Ligand Name |
3-[4-[(2~{r},3~{s},4~{s},5~{s},6~{r})-6-(Hydroxymethyl)-3,4,5-Tris(Oxidanyl)oxan-2-Yl]oxy-3-Methyl-Phenyl]-~{n}-Methyl-Benzamide
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| Synonyms |
CHEMBL2058201; 3-[4-[(2~{r},3~{s},4~{s},5~{s},6~{r})-6-(Hydroxymethyl)-3,4,5-Tris(Oxidanyl)oxan-2-Yl]oxy-3-Methyl-Phenyl]-~{n}-Methyl-Benzamide; SCHEMBL12476327; BDBM50197185; 5US; N-methyl-3-[3-methyl-4-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]benzamide
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| Structure |
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Download2D MOL |
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| Formula |
C21H25NO7
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| Canonical SMILES |
CC1=C(C=CC(=C1)C2=CC(=CC=C2)C(=O)NC)OC3C(C(C(C(O3)CO)O)O)O
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| InChI |
1S/C21H25NO7/c1-11-8-13(12-4-3-5-14(9-12)20(27)22-2)6-7-15(11)28-21-19(26)18(25)17(24)16(10-23)29-21/h3-9,16-19,21,23-26H,10H2,1-2H3,(H,22,27)/t16-,17-,18+,19+,21+/m1/s1
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| InChIKey |
LECOXVSYFKTZFV-AGRFSFNASA-N
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| PubChem Compound ID | ||||
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