Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BR1H5A
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| Binder Name |
Lithocholic acid glucuronide
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| Synonyms |
CHEMBL3763659; Lithocholic acid 3-glucuronide; Lithocholate 3-O-beta-D-glucuronide; LCA-3G; lithocholic acid 3-beta-glucuronide; BDBM50139646; lithocholic acid 3-beta-D-glucuronide; lithocholic acid 3-O-(beta-D-glucuronide); 3alpha-(beta-D-glucopyranuronosyloxy)-5beta-cholan-24-oic acid; 24-hydroxy-24-oxo-5beta-cholan-3alpha-yl beta-D-glucopyranosiduronic acid; 3alpha-hydroxy-5beta-cholan-24-oic acid 3-beta-D-glucopyranuronoside; (3alpha,5beta)-24-hydroxy-24-oxocholan-3-yl beta-D-glucopyranosiduronic acid
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL |
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| Formula |
C30H48O9
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| Canonical SMILES |
C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)C)C
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| InChI |
1S/C30H48O9/c1-15(4-9-22(31)32)19-7-8-20-18-6-5-16-14-17(10-12-29(16,2)21(18)11-13-30(19,20)3)38-28-25(35)23(33)24(34)26(39-28)27(36)37/h15-21,23-26,28,33-35H,4-14H2,1-3H3,(H,31,32)(H,36,37)/t15-,16-,17-,18+,19-,20+,21+,23+,24+,25-,26+,28-,29+,30-/m1/s1
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| InChIKey |
GIQXKAXWRLHLDD-VYACWCJYSA-N
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| PubChem Compound ID | ||||
| ChEBI ID |
CHEBI:137921
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