Binder Information
Binder General Information | Top | |||
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Binder ID |
BL82PS
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Binder Name |
Chembl413369
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Synonyms |
CHEMBL3215417; BDBM50288834
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C49H78N4O26
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Canonical SMILES |
C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@]4(C[C@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)CO)OCCCCCCNC(=O)C5CCC(CC5)CN6C(=O)C=CC6=O)NC(=O)C)O)O)O
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InChI |
1S/C49H78N4O26/c1-21-34(63)37(66)38(67)46(73-21)77-42-33(52-23(3)58)45(72-15-7-5-4-6-14-50-44(69)25-10-8-24(9-11-25)17-53-30(61)12-13-31(53)62)75-29(20-56)40(42)76-47-39(68)43(36(65)28(19-55)74-47)79-49(48(70)71)16-26(59)32(51-22(2)57)41(78-49)35(64)27(60)18-54/h12-13,21,24-29,32-43,45-47,54-56,59-60,63-68H,4-11,14-20H2,1-3H3,(H,50,69)(H,51,57)(H,52,58)(H,70,71)/t21-,24?,25?,26+,27+,28-,29-,32+,33-,34+,35+,36-,37-,38-,39-,40+,41+,42+,43-,45+,46-,47-,49-/m0/s1
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InChIKey |
IIRKVOHVOWGUBD-XFWUECTNSA-N
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PubChem Compound ID |
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