Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L8Z1LW
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| Ligand Name |
(2~{R},3~{R},4~{S},5~{R},6~{S})-4-[4-(4-fluoranyl-3-methyl-phenyl)-1,2,3-triazol-1-yl]-2-(hydroxymethyl)-6-(4-methylphenyl)sulfanyl-oxane-3,5-diol
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| Synonyms |
CHEMBL4072396; (2~{R},3~{R},4~{S},5~{R},6~{S})-4-[4-(4-fluoranyl-3-methyl-phenyl)-1,2,3-triazol-1-yl]-2-(hydroxymethyl)-6-(4-methylphenyl)sulfanyl-oxane-3,5-diol; BDBM50247485; J62
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| Structure |
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Download2D MOL |
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| Formula |
C22H24FN3O4S
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| Canonical SMILES |
CC1=CC=C(C=C1)SC2C(C(C(C(O2)CO)O)N3C=C(N=N3)C4=CC(=C(C=C4)F)C)O
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| InChI |
1S/C22H24FN3O4S/c1-12-3-6-15(7-4-12)31-22-21(29)19(20(28)18(11-27)30-22)26-10-17(24-25-26)14-5-8-16(23)13(2)9-14/h3-10,18-22,27-29H,11H2,1-2H3/t18-,19+,20+,21-,22+/m1/s1
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| InChIKey |
YMMGKBVLXHTWGR-CTWRKMMKSA-N
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| PubChem Compound ID | ||||
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