Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L1KFH4
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| Ligand Name |
(3S)-3-[[(3S,6S,10aS)-6-(isoquinoline-1-carbonylamino)-5-oxo-2,3,6,7,8,9,10,10a-octahydro-1H-pyrrolo[1,2-a]azocine-3-carbonyl]amino]-4-hydroxybutanoic acid
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| Structure |
 |
Download2D MOL |
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| Formula |
C25H30N4O6
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| Canonical SMILES |
C1CCC(C(=O)N2C(C1)CCC2C(=O)NC(CC(=O)O)CO)NC(=O)C3=NC=CC4=CC=CC=C43
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| InChI |
1S/C25H30N4O6/c30-14-16(13-21(31)32)27-23(33)20-10-9-17-6-2-4-8-19(25(35)29(17)20)28-24(34)22-18-7-3-1-5-15(18)11-12-26-22/h1,3,5,7,11-12,16-17,19-20,30H,2,4,6,8-10,13-14H2,(H,27,33)(H,28,34)(H,31,32)/t16-,17-,19-,20-/m0/s1
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| InChIKey |
AVBDMGZDLMBHDP-ZULIPRJHSA-N
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| PubChem Compound ID | ||||
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