Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L1ZGS7
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| Ligand Name |
(2s)-2-{[(R)-[(3r)-3-Carboxy-3-{[(4-{[(2,4-Diaminopteridin-6-Yl)methyl](Methyl)amino}phenyl)carbonyl]amino}propyl](Hydroxy)phosphoryl]methyl}pentanedioic Acid
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| Synonyms |
(2s)-2-{[(R)-[(3r)-3-Carboxy-3-{[(4-{[(2,4-Diaminopteridin-6-Yl)methyl](Methyl)amino}phenyl)carbonyl]amino}propyl](Hydroxy)phosphoryl]methyl}pentanedioic Acid; Q27453681; 3BI
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| Structure |
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Download2D MOL
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| Formula |
C25H31N8O9P
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| Canonical SMILES |
CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCP(=O)(CC(CCC(=O)O)C(=O)O)O)C(=O)O
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| InChI |
1S/C25H31N8O9P/c1-33(11-15-10-28-21-19(29-15)20(26)31-25(27)32-21)16-5-2-13(3-6-16)22(36)30-17(24(39)40)8-9-43(41,42)12-14(23(37)38)4-7-18(34)35/h2-3,5-6,10,14,17H,4,7-9,11-12H2,1H3,(H,30,36)(H,34,35)(H,37,38)(H,39,40)(H,41,42)(H4,26,27,28,31,32)/t14-,17-/m1/s1
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| InChIKey |
BHCAHIKEPKIXJL-RHSMWYFYSA-N
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| PubChem Compound ID | ||||
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