codeine
AlkaPlorer ID: AK001135
Synonym: '(-)-Codeine', 'methylmorphine', 'morphine 3-methyl ether', 'l-codeine', 'morphine monomethyl ether', 'O(3)-methylmorphine', 'Codein', 'Codeine', 'morphine-3-methyl ether', '7,8-didehydro-4,5alpha-epoxy-3-methoxy-17-methylmorphinan-6alpha-ol', '(5alpha,6alpha)-7,8-Didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-6-ol', '(1S,13R,14S,17R)-10-methoxy-4-methyl-12-oxa-4-azapentacyclo9.6.1.0(1,13).0(5,17).0(7,18)octadeca-7(18),8,10,15-tetraen-14-ol', 'codeine anhydrous'
IUPAC Name: (4R,4aR,7R,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol
Structure
SMILES: COC1=C2O[C@H]3[C@H](O)C=C[C@H]4[C@H]5CC(=C2[C@]43CCN5C)C=C1
InChI: InChI=1S/C18H21NO3/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/t11-,12+,13+,17-,18-/m0/s1
InChIKey: OROGSEYTTFOCAN-KEMUOJQUSA-N
Reference
PubChem CID: 5324288
CAS: 509-64-8
LOTUS: LTS0078907
SuperNatural Ⅲ: SN0273392-10
NPASS: NPC235802
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Papaver somniferum | Papaver | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Aloe microstigma | Aloe | Asphodelaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 299.36999999999995
TPSA？: 41.93
MolLogP？: 1.5011
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|