Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LKR8B7
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| Ligand Name |
2,4-dihydroxy-3-[3-[(1R,2S,3S,7S,9R,10R,13R)-13-hydroxy-3,10-dimethyl-4-oxo-11-oxapentacyclo[7.2.1.17,10.01,9.02,7]tridec-5-en-3-yl]propanoylamino]benzoic acid
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| Synonyms |
CHEMBL1230599; BDBM50483833
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| Structure |
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Download2D MOL
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| Formula |
C24H25NO8
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| Canonical SMILES |
CC1(C2C3(CC45C2(C4)OC5(C3O)C)C=CC1=O)CCC(=O)NC6=C(C=CC(=C6O)C(=O)O)O
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| InChI |
1S/C24H25NO8/c1-20(7-6-14(28)25-15-12(26)4-3-11(16(15)29)17(30)31)13(27)5-8-22-9-23-10-24(23,18(20)22)33-21(23,2)19(22)32/h3-5,8,18-19,26,29,32H,6-7,9-10H2,1-2H3,(H,25,28)(H,30,31)/t18-,19+,20-,21+,22-,23+,24-/m1/s1
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| InChIKey |
TUHIUIGYYSZKCN-ACYPNERUSA-N
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| PubChem Compound ID | ||||
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