E07
Summary
| Name: | TRIHYDROXY-[(1S)-1-[[2-(PHENYLMETHYL)PHENYL]CARBONYLAMINO]ETHYL]BORON |
| Formula: | C16 H19 B N O4 |
| Formal charge: | -1 |
| Formula weight: | 300.137 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.6.1 | trihydroxy-[(1S)-1-[[2-(phenylmethyl)phenyl]carbonylamino]ethyl]boron |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | C[C@@H](NC(=O)c1ccccc1Cc2ccccc2)[B](O)(O)O |
| SMILES | CACTVS | 3.352 | C[CH](NC(=O)c1ccccc1Cc2ccccc2)[B](O)(O)O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | B([C@@H](C)NC(=O)c1ccccc1Cc2ccccc2)(O)(O)O |
| SMILES | OpenEye OEToolkits | 1.6.1 | B(C(C)NC(=O)c1ccccc1Cc2ccccc2)(O)(O)O |
| InChI | InChI | 1.03 | InChI=1S/C16H19BNO4/c1-12(17(20,21)22)18-16(19)15-10-6-5-9-14(15)11-13-7-3-2-4-8-13/h2-10,12,20-22H,11H2,1H3,(H,18,19)/q-1/t12-/m1/s1 |
| InChIKey | InChI | 1.03 | KXUAFLYMMJHXHZ-GFCCVEGCSA-N |
