PA2
Summary
Name: | PAROMOMYCIN (RING 2) |
Formula: | C6 H14 N2 O2 |
Formal charge: | 0 |
Formula weight: | 146.188 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (1S,2S,3R,5S)-3,5-diaminocyclohexane-1,2-diol |
OpenEye OEToolkits | 1.5.0 | (1S,2S,3R,5S)-3,5-diaminocyclohexane-1,2-diol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OC1CC(N)CC(N)C1O |
SMILES_CANONICAL | CACTVS | 3.341 | N[C@H]1C[C@@H](N)[C@H](O)[C@@H](O)C1 |
SMILES | CACTVS | 3.341 | N[CH]1C[CH](N)[CH](O)[CH](O)C1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1[C@@H](C[C@@H]([C@H]([C@@H]1N)O)O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | C1C(CC(C(C1N)O)O)N |
InChI | InChI | 1.03 | InChI=1S/C6H14N2O2/c7-3-1-4(8)6(10)5(9)2-3/h3-6,9-10H,1-2,7-8H2/t3-,4+,5-,6-/m0/s1 |
InChIKey | InChI | 1.03 | QOLDZWBHLDQIJR-FSIIMWSLSA-N |