IOV
(1R,2S)-2-{[5-carbamoyl-3-(ethoxycarbonyl)-4-methylthiophen-2-yl]carbamoyl}cyclohexane-1-carboxylic acid
Find entries where: IOV
is present as a standalone ligand in 2 entries
Chemical Component Summary | |
|---|---|
| Name | (1R,2S)-2-{[5-carbamoyl-3-(ethoxycarbonyl)-4-methylthiophen-2-yl]carbamoyl}cyclohexane-1-carboxylic acid |
| Identifiers | (1~{R},2~{S})-2-[(5-aminocarbonyl-3-ethoxycarbonyl-4-methyl-thiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid |
| Formula | C17 H22 N2 O6 S |
| Molecular Weight | 382.431 |
| Type | NON-POLYMER |
| Isomeric SMILES | CCOC(=O)c1c(c(sc1NC(=O)[C@H]2CCCC[C@H]2C(=O)O)C(=O)N)C |
| InChI | InChI=1S/C17H22N2O6S/c1-3-25-17(24)11-8(2)12(13(18)20)26-15(11)19-14(21)9-6-4-5-7-10(9)16(22)23/h9-10H,3-7H2,1-2H3,(H2,18,20)(H,19,21)(H,22,23)/t9-,10+/m0/s1 |
| InChIKey | AGKODQIAZDTMGB-VHSXEESVSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 48 |
| Chiral Atom Count | 2 |
| Bond Count | 49 |
| Aromatic Bond Count | 5 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 1752219 |
