Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BIFJ14
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| Binder Name |
21beta-O,22alpha-O-Diangeloylbarringtogenol C
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| Synonyms |
CHEMBL1094676; BDBM50317506; 21,22-O-Diangeloyl-3beta,16alpha,28-trihydroxyolean-12-ene
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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 |
C40H62O7
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| Canonical SMILES |
C/C=C(/C)\\C(=O)O[C@H]1[C@@H](C(C[C@@H]2[C@]1([C@@H](C[C@@]3(C2=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)C)O)CO)(C)C)OC(=O)/C(=C\\C)/C
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| InChI |
1S/C40H62O7/c1-12-23(3)33(44)46-31-32(47-34(45)24(4)13-2)40(22-41)26(20-35(31,5)6)25-14-15-28-37(9)18-17-29(42)36(7,8)27(37)16-19-38(28,10)39(25,11)21-30(40)43/h12-14,26-32,41-43H,15-22H2,1-11H3/b23-12-,24-13-/t26-,27-,28+,29-,30+,31-,32-,37-,38+,39+,40-/m0/s1
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| InChIKey |
UWVCGANXBDMPOF-MUGRVRNSSA-N
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| PubChem Compound ID | ||||
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