
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 76-57-3 |
| Catalog No. | 2A-9059636 |
| Chinese Name | 可待因 |
| Synonyms | 3-methoxy-17-methyl-7,8-didehydro-4,5alpha-epoxymorphinan-6alpha-ol; 7,8-didehydro-4,5alpha-epoxy-3-methoxy-17-methylmorphinan-6alpha-ol; CHEBI:16714; Codein; O(3)-methylmorphine |
| Molecular Formula | C18H21NO3 |
| Molecular Weight | 420.37 |
| Purity | 98 |
| EINECS | 200-969-1 |
| MDL Number | MFCD00153030 |
| SMILES | COc1ccc2C[C@@H]3[C@@H]4C=C[C@H](O)[C@@H]5Oc1c2[C@]45CCN3C |
| 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 |
| InChI Key | InChIKey=OROGSEYTTFOCAN-DNJOTXNNSA-N |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
| MSDS | msds/59636_1_76_57_3.pdf |
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