Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LKRG41
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| Ligand Name |
2,7-Dibenzyl-1,1-dioxo-3,6-bis-phenoxymethyl-[1,2,7]thiadiazepane-4,5-diol
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| Synonyms |
CHEMBL130998; 2,7-DIBENZYL-1,1-DIOXO-3,6-BIS-PHENOXYMETHYL-[1,2,7]THIADIAZEPANE-4,5-DIOL; Cyclic Sulfamide deriv. 19; 1ajv; Cyclic Sulfamide 4; BDBM1163; SCHEMBL13981302; AHA-006; (3R,4S,5S,6R)-2,7-dibenzyl-1,1-dioxo-3,6-bis(phenoxymethyl)-1,2,7-thiadiazepane-4,5-diol; Q27463866; (3R,4S,5S,6R)-2,7-Dibenzyl-3,6-bis(phenoxymethyl)-4,5-dihydroxy-1,2,7-thiadiazepan 1,1-Dioxide; (3R,4S,5S,6R)-2,7-Dibenzyl-3,6-bis(phenoxymethyl)-4,5-dihydroxy-1,2,7-thiadiazepane, 1,1-dioxide; (3R,4S,5S,6R)-2,7-dibenzyl-4,5-dihydroxy-3,6-bis(phenoxymethyl)-1$l^{6},2,7-thiadiazepane-1,1-dione
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| Structure |
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Download2D MOL |
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| Formula |
C32H34N2O6S
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| Canonical SMILES |
C1=CC=C(C=C1)CN2C(C(C(C(N(S2(=O)=O)CC3=CC=CC=C3)COC4=CC=CC=C4)O)O)COC5=CC=CC=C5
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| InChI |
1S/C32H34N2O6S/c35-31-29(23-39-27-17-9-3-10-18-27)33(21-25-13-5-1-6-14-25)41(37,38)34(22-26-15-7-2-8-16-26)30(32(31)36)24-40-28-19-11-4-12-20-28/h1-20,29-32,35-36H,21-24H2/t29-,30-,31+,32+/m1/s1
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| InChIKey |
CAGHBXQSDLNCES-ZRTHHSRSSA-N
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| PubChem Compound ID | ||||
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