Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BIL1D6
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| Binder Name |
(1S,2R,4As,6aR,6aR,6bR,8aR,10S,12aR,14bS)-4a-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxycarbonyl-1,2,6b,9,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-6a-carboxylic acid
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| Synonyms |
CHEMBL1095353; BDBM50317550
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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 |
C47H74O19
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| Canonical SMILES |
C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)C)[C@@H]2[C@H]1C)C(=O)O)C(=O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O[C@H]8[C@@H]([C@H]([C@H](CO8)O)O)O
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| InChI |
1S/C47H74O19/c1-20-9-14-46(42(60)66-40-37(34(55)32(53)25(18-49)63-40)65-38-35(56)30(51)23(50)19-61-38)15-16-47(41(58)59)22(29(46)21(20)2)7-8-27-44(5)12-11-28(43(3,4)26(44)10-13-45(27,47)6)64-39-36(57)33(54)31(52)24(17-48)62-39/h7,20-21,23-40,48-57H,8-19H2,1-6H3,(H,58,59)/t20-,21+,23+,24-,25-,26+,27-,28+,29+,30+,31-,32-,33+,34+,35-,36-,37-,38+,39+,40+,44+,45-,46+,47-/m1/s1
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| InChIKey |
CBQDXIKXHJRSOQ-WKHOJSDHSA-N
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| PubChem Compound ID | ||||
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