EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H20ClNO5 |
| Net Charge | 0 |
| Average Mass | 269.725 |
| Monoisotopic Mass | 269.10300 |
| SMILES | [H]OC([H])(O[H])[C@]([H])(O[H])N([H])[C@@]1([H])C([H])([H])C([H])([H])[C@]([H])(Cl)C([H])([H])[C@]1([H])[C@]([H])(O[H])OC([H])([H])[H] |
| InChI | InChI=1S/C10H20ClNO5/c1-17-10(16)6-4-5(11)2-3-7(6)12-8(13)9(14)15/h5-10,12-16H,2-4H2,1H3/t5-,6-,7-,8-,10+/m0/s1 |
| InChIKey | ZCXQIUYGWAQWDL-RZKMHQGSSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-({4-CHLORO-2-[HYDROXY(METHOXY)METHYL]CYCLOHEXYL}AMINO)ETHANE-1,1,2-TRIOL (CHEBI:49874) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 2-({4-CHLORO-2-[HYDROXY(METHOXY)METHYL]CYCLOHEXYL}AMINO)ETHANE-1,1,2-TRIOL | PDBeChem |
| (2S)-2-({(1S,2S,4S)-4-chloro-2-[(R)-hydroxy(methoxy)methyl]cyclohexyl}amino)ethane-1,1,2-triol | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| RB2 | PDBeChem |