Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BW4QI1
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| Binder Name |
(2S,4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-Dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]-2-methylpentanoic acid
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| Synonyms |
SCHEMBL592933; CHEMBL583611; BDBM21676; 23(S)-methyl-BA derivative, 7a; 23(S)-methyl-chenodeoxycholic acid; 23(S)-Methyl-3alpha,7alpha-dihydroxy-5beta-cholan-24-oic 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 |
C25H42O4
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| Canonical SMILES |
C[C@H](C[C@H](C)C(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C
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| InChI |
1S/C25H42O4/c1-14(11-15(2)23(28)29)18-5-6-19-22-20(8-10-25(18,19)4)24(3)9-7-17(26)12-16(24)13-21(22)27/h14-22,26-27H,5-13H2,1-4H3,(H,28,29)/t14-,15+,16+,17-,18-,19+,20+,21-,22+,24+,25-/m1/s1
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| InChIKey |
XMIXAXLPZCFFCG-BQWNBIDXSA-N
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| PubChem Compound ID | ||||
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