c
codeine monohydrate
Chemical compound
Also known as codeine hydrate
- Formula
- C₁₈H₂₃NO₄
1
- C₁₈H₂₃NO₄
- Mass
- 317.163 Da
1
- 317.163 Da
Chemistry
All data
20 statements · 75% with external sources · numbers in brackets are citations
- Canonical SMILES
- CN1CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(C=C4)O.O
1
- CN1CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(C=C4)O.O
- Isomeric SMILES
- CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.O
1
- CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.O
On other databases
13 identifiers linking codeine monohydrate across the web's reference databases
- CAS Registry Number6059-47-8
- ChEMBL IDCHEMBL369475
- ChemSpider ID4515050
- DSSTOX compound identifierDTXCID40131882
- DSSTox substance IDDTXSID20209391
- EC number641-609-7
- ECHA Substance Infocard ID100.169.472
- InChIInChI=1S/C18H21NO3.H2O/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19;/h3-6,11-13,17,20H,7-9H2,1-2H3;1H2/t11-,12+,13-,17-,18-;/m0./s1
- InChIKeyWRRSFOZOETZUPG-FFHNEAJVSA-N
- PubChem CID5362471
- SureChEMBL ID3031563
- UniChem compound ID297786
- UNIIQ830PW7520