Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L1NE8P
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| Ligand Name |
(12S,14S,17E)-12-(hydroxymethyl)-24-oxo-15,20-dioxa-2,4,5,9,11,23-hexazahexacyclo[19.7.1.13,10.111,14.04,8.022,27]hentriaconta-1(28),3(31),5,7,9,17,21(29),22(27)-octaene-7-carbonitrile
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| Synonyms |
CHEMBL4094351
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| Structure |
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Download2D MOL |
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| Formula |
C25H25N7O4
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| Canonical SMILES |
C1CC(=O)NC2=C1C=C3C=C2OCC=CCOC4CC(N(C4)C5=NC6=C(C=NN6C(=C5)N3)C#N)CO
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| InChI |
1S/C25H25N7O4/c26-11-16-12-27-32-22-10-21(29-25(16)32)31-13-19(9-18(31)14-33)35-5-1-2-6-36-20-8-17(28-22)7-15-3-4-23(34)30-24(15)20/h1-2,7-8,10,12,18-19,28,33H,3-6,9,13-14H2,(H,30,34)/b2-1+/t18-,19-/m0/s1
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| InChIKey |
SABLEOBBNNRHAD-WNJMFGOSSA-N
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| PubChem Compound ID | ||||
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