Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L42AHI
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| Ligand Name |
N-[(1e,2r)-1-[(2r)-2-{[(2s)-1-Amino-5-Carbamimidamido-1-Oxopentan-2-Yl]carbamoyl}cyclopentylidene]-3-(Phosphonooxy)propan-2-Yl]-L-Phenylalaninamide
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| Synonyms |
N-[(1e,2r)-1-[(2r)-2-{[(2s)-1-Amino-5-Carbamimidamido-1-Oxopentan-2-Yl]carbamoyl}cyclopentylidene]-3-(Phosphonooxy)propan-2-Yl]-L-Phenylalaninamide; Q27454121; 3TB
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| Structure |
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Download2D MOL
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| Formula |
C24H38N7O7P
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| Canonical SMILES |
C1CC(C(=CC(COP(=O)(O)O)NC(=O)C(CC2=CC=CC=C2)N)C1)C(=O)NC(CCCN=C(N)N)C(=O)N
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| InChI |
1S/C24H38N7O7P/c25-19(12-15-6-2-1-3-7-15)23(34)30-17(14-38-39(35,36)37)13-16-8-4-9-18(16)22(33)31-20(21(26)32)10-5-11-29-24(27)28/h1-3,6-7,13,17-20H,4-5,8-12,14,25H2,(H2,26,32)(H,30,34)(H,31,33)(H4,27,28,29)(H2,35,36,37)/b16-13+/t17-,18-,19+,20+/m1/s1
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| InChIKey |
UFUNWHANDTZFCQ-BELXZNSDSA-N
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| PubChem Compound ID | ||||
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