Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L8OJ2Y
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| Ligand Name |
2-[(3~{s},3'~{a}~{s},6'~{s},6'~{a}~{s})-6-Chloranyl-6'-(3-Chlorophenyl)-4'-(Cyclopropylmethyl)-2-Oxidanylidene-Spiro[1~{h}-Indole-3,5'-3,3~{a},6,6~{a}-Tetrahydro-2~{h}-Pyrrolo[3,2-B]pyrrole]-1'-Yl]ethanoic Acid
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| Synonyms |
CHEMBL4739921; SCHEMBL17167705; 2-[(3~{s},3'~{a}~{s},6'~{s},6'~{a}~{s})-6-Chloranyl-6'-(3-Chlorophenyl)-4'-(Cyclopropylmethyl)-2-Oxidanylidene-Spiro[1~{h}-Indole-3,5'-3,3~{a},6,6~{a}-Tetrahydro-2~{h}-Pyrrolo[3,2-B]pyrrole]-1'-Yl]ethanoic Acid; 6SJ
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| Structure |
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Download2D MOL |
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| Formula |
C25H25Cl2N3O3
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| Canonical SMILES |
C1CC1CN2C3CCN(C3C(C24C5=C(C=C(C=C5)Cl)NC4=O)C6=CC(=CC=C6)Cl)CC(=O)O
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| InChI |
1S/C25H25Cl2N3O3/c26-16-3-1-2-15(10-16)22-23-20(8-9-29(23)13-21(31)32)30(12-14-4-5-14)25(22)18-7-6-17(27)11-19(18)28-24(25)33/h1-3,6-7,10-11,14,20,22-23H,4-5,8-9,12-13H2,(H,28,33)(H,31,32)/t20-,22-,23+,25+/m0/s1
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| InChIKey |
PECRYANCKVXSRI-FDHFVPJWSA-N
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| PubChem Compound ID | ||||
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