POO
3-CYCLOHEXYL-1-(2-{METHYL[(1-METHYLPIPERIDIN-3-YL)METHYL]AMINO}-2-OXOETHYL)-2-PHENYL-1H-INDOLE-6-CARBOXYLIC ACID
Find entries where: POO
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 3-CYCLOHEXYL-1-(2-{METHYL[(1-METHYLPIPERIDIN-3-YL)METHYL]AMINO}-2-OXOETHYL)-2-PHENYL-1H-INDOLE-6-CARBOXYLIC ACID |
Identifiers | 3-cyclohexyl-1-[2-[methyl-[[(1S,3R)-1-methylpiperidin-3-yl]methyl]amino]-2-oxo-ethyl]-2-phenyl-indole-6-carboxylic acid |
Formula | C31 H39 N3 O3 |
Molecular Weight | 501.66 |
Type | NON-POLYMER |
Isomeric SMILES | C[N@]1CCC[C@H](C1)CN(C)C(=O)Cn2c3cc(ccc3c(c2c4ccccc4)C5CCCCC5)C(=O)O |
InChI | InChI=1S/C31H39N3O3/c1-32-17-9-10-22(19-32)20-33(2)28(35)21-34-27-18-25(31(36)37)15-16-26(27)29(23-11-5-3-6-12-23)30(34)24-13-7-4-8-14-24/h4,7-8,13-16,18,22-23H,3,5-6,9-12,17,19-21H2,1-2H3,(H,36,37)/t22-/m1/s1 |
InChIKey | AWVLDLUQVKNAMT-JOCHJYFZSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 76 |
Chiral Atom Count | 1 |
Bond Count | 80 |
Aromatic Bond Count | 17 |
Related Resource References
Resource Name | Reference |
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PubChem | 4369535 |