Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LDSZ67
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Ligand Name |
(1R,3S,6S,18R,27R)-6-(6,6-dihydroxyoctyl)-5,8,18,27,34-pentaazahexacyclo[25.2.2.1~7,10~.1~11,15~.1~14,18~.0~1,3~]tetratriaconta-7,9,11(33),12,14,16-hexaene-4,32-dione (non-preferred name)
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Synonyms |
(1R,3S,6S,18R,27R)-6-(6,6-dihydroxyoctyl)-5,8,18,27,34-pentaazahexacyclo[25.2.2.1~7,10~.1~11,15~.1~14,18~.0~1,3~]tetratriaconta-7,9,11(33),12,14,16-hexaene-4,32-dione (non-preferred name)
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Structure |
Download2D MOL |
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Formula |
C37H54N5O4+
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Canonical SMILES |
CCC(CCCCCC1C2=[NH+]C=C(N2)C3=CC4=C(C=C3)C(=O)N(CCCCCCCCN5CCC6(CC5)CC6C(=O)N1)C=C4)(O)O
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InChI |
1S/C37H53N5O4/c1-2-37(45,46)16-9-7-8-12-31-33-38-26-32(39-33)28-13-14-29-27(24-28)15-21-42(35(29)44)20-11-6-4-3-5-10-19-41-22-17-36(18-23-41)25-30(36)34(43)40-31/h13-15,21,24,26,30-31,45-46H,2-12,16-20,22-23,25H2,1H3,(H,38,39)(H,40,43)/p+1/t30-,31+/m1/s1
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InChIKey |
RRBSQOKVWUOYST-JSOSNVBQSA-O
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PubChem Compound ID |
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