Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L57LUM
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| Ligand Name |
(12s)-12-[(1r)-2-{[(4s)-6-Ethyl-3,4-Dihydrospiro[chromene-2,1'-Cyclobutan]-4-Yl]amino}-1-Hydroxyethyl]-1,13-Diazatricyclo[13.3.1.1~6,10~]icosa-6(20),7,9,15(19),16-Pentaene-14,18-Dione
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| Synonyms |
CHEMBL2407488; (12s)-12-[(1r)-2-{[(4s)-6-Ethyl-3,4-Dihydrospiro[chromene-2,1'-Cyclobutan]-4-Yl]amino}-1-Hydroxyethyl]-1,13-Diazatricyclo[13.3.1.1~6,10~]icosa-6(20),7,9,15(19),16-Pentaene-14,18-Dione; BDBM50437545; Q27452368; 1R6
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| Structure |
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Download2D MOL |
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| Formula |
C34H41N3O4
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| Canonical SMILES |
CCC1=CC2=C(C=C1)OC3(CCC3)CC2NCC(C4CC5=CC=CC(=C5)CCCCN6C=C(C=CC6=O)C(=O)N4)O
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| InChI |
1S/C34H41N3O4/c1-2-23-10-12-31-27(18-23)29(20-34(41-31)14-6-15-34)35-21-30(38)28-19-25-9-5-8-24(17-25)7-3-4-16-37-22-26(33(40)36-28)11-13-32(37)39/h5,8-13,17-18,22,28-30,35,38H,2-4,6-7,14-16,19-21H2,1H3,(H,36,40)/t28-,29-,30+/m0/s1
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| InChIKey |
LCSGKLXXIKDHLA-OIFRRMEBSA-N
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| PubChem Compound ID | ||||
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