Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LA5B9I
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| Ligand Name |
(2R,5S,11S,14S,18E)-2,11-dimethyl-14-(propan-2-yl)-3-oxa-9,12,15,21,29-pentaazatetracyclo[18.5.3.1~5,9~.0~23,27~]nonacosa-1(26),18,20,22,24,27-hexaene-4,10,13,16-tetrone
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| Synonyms |
CHEMBL4167017; (2R,5S,11S,14S,18E)-2,11-dimethyl-14-(propan-2-yl)-3-oxa-9,12,15,21,29-pentaazatetracyclo[18.5.3.1~5,9~.0~23,27~]nonacosa-1(26),18,20,22,24,27-hexaene-4,10,13,16-tetrone; SCHEMBL15451985; BDBM50450023; UO7
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| Structure |
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Download2D MOL |
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| Formula |
C28H35N5O5
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| Canonical SMILES |
CC1C(=O)N2CCCC(N2)C(=O)OC(C3=CC4=CC(=NC=C4C=C3)C=CCC(=O)NC(C(=O)N1)C(C)C)C
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| InChI |
1S/C28H35N5O5/c1-16(2)25-26(35)30-17(3)27(36)33-12-6-8-23(32-33)28(37)38-18(4)19-10-11-20-15-29-22(14-21(20)13-19)7-5-9-24(34)31-25/h5,7,10-11,13-18,23,25,32H,6,8-9,12H2,1-4H3,(H,30,35)(H,31,34)/b7-5+/t17-,18+,23-,25-/m0/s1
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| InChIKey |
MGYHGMOTCTUOQS-NGJNAYBBSA-N
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| PubChem Compound ID | ||||
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