Basic information
- CAS
1346603-23-3- Standard SMILES
[2H]C([2H])([2H])N1CCc2cc(OC)c(O)cc2[C@@H]1Cc1ccc(OC)c(O)c1- InChIKey
BHLYRWXGMIUIHG-VSLDJYOXSA-N- Molecular formula
- C19H23NO4
- Average molar mass
- 332.4 g/mol
- Monoisotopic mass
- 332.18153845
Names & identifiers
- Preferred name
- Reticuline-d3
- IUPAC
- (1S)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-(trideuteriomethyl)-3,4-dihydro-1H-isoquinolin-7-ol
- English name
- Reticuline-d3
- Molecular formula
- C19H23NO4
- Molecular weight
- 329.4
Names & synonyms
Reticuline-d31346603-23-3(1S)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-(trideuteriomethyl)-3,4-dihydro-1H-isoquinolin-7-olSCHEMBL29924186HY-N1356SDTXSID60858367CS-0202173(1S)-1-[(3-Hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-(~2~H_3_)methyl-1,2,3,4-tetrahydroisoquinolin-7-olReticulin-d3d-Reticuline-d3(R)-Reticuline-d3L-(+)-Reticuline-d3
Show more names
S-(+)-Reticuline-d3(R)-(-)-Reticuline-d3(1R)-1,2,3,4-tetrahydro-1-[(3-hydroxy-4-Methoxyphenyl)Methyl]-6-Methoxy-2-Methyl-7-Isoquinolinol-d3(1S)-1,2,3,4-Tetrahydro-1-[(3-hydroxy-4-Methoxyphenyl)Methyl]-6-Methoxy-2-(Methyl-d3)-7-isoquinolinol
Database identifiers
- CAS
1346603-23-3- PubChem CID
- 71752017
- DTXSID
DTXSID60858367
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 407
Physicochemical properties
- Melting point
- 96 · 96-112°C
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Methanol
- form
- Solid
- color
- Off-White to Pale Yellow
Chemistry & industry
Applications
UsesLabelled Reticuline (R188500). Precursor of many aporphine and morphine-type alkaloids.
UsesLabelled analogue of (R)-Reticuline, the (R)-enantiomer of Reticuline, a tetrahydrobenzylisoquinoline alkaloid found in opium. (R)-Reticuline is converted into Salutaridine by a membrane-bound cytochr ome P-450 enzyme from Papaver somniferum
Suppliers4 total
凯试（上海）科技有限公司021-50135380 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
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Compound notes
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