Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L5N9BK
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| Ligand Name |
4-[(1R,3AS,4R,8AS,8BR)-1-Isopropyl-2-(4-methoxybenzyl)-3-oxodecahydropyrrolo[3,4-A]pyrrolizin-4-YL]benzenecarboximidamide
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| Synonyms |
4-[(1R,3AS,4R,8AS,8BR)-1-ISOPROPYL-2-(4-METHOXYBENZYL)-3-OXODECAHYDROPYRROLO[3,4-A]PYRROLIZIN-4-YL]BENZENECARBOXIMIDAMIDE; 2cf9; CHEMBL1230037; Q27453532; (3aalpha,3bbeta,7aalpha)-3alpha-Isopropyl-2-(4-methoxybenzyl)-7beta-(4-amidinophenyl)decahydro-2,6a-diaza-6aH-cyclopenta[a]pentalene-1-one
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| Structure |
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Download2D MOL |
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| Formula |
C27H34N4O2
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| Canonical SMILES |
CC(C)C1C2C3CCCN3C(C2C(=O)N1CC4=CC=C(C=C4)OC)C5=CC=C(C=C5)C(=N)N
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| InChI |
1S/C27H34N4O2/c1-16(2)24-22-21-5-4-14-30(21)25(18-8-10-19(11-9-18)26(28)29)23(22)27(32)31(24)15-17-6-12-20(33-3)13-7-17/h6-13,16,21-25H,4-5,14-15H2,1-3H3,(H3,28,29)/t21-,22-,23-,24+,25-/m0/s1
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| InChIKey |
XETNTDPUFDNJKX-BDUWWWMKSA-N
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| PubChem Compound ID | ||||
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