Salsolidine
PubChem CID: 164752
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| Compound Synonyms | (S)-Salsolidine, Salsolidin, 493-48-1, (-)-Salsolidine, (S)-(-)-Salsolidine, (S)-6,7-Dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline, (1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline, UNII-QMS4D62O1I, QMS4D62O1I, SALSOLIDINE, (-)-, Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-methyl-, (1S)-, Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-methyl-, (S)-, N-Norcarnegine, (+-)-Salsolidine, 1-Methyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline, SCHEMBL4250569, CHEMBL1196026, HMYJLVDKPJHJCF-QMMMGPOBSA-N, DTXSID601318133, TNP00026, HY-22385B, STK080959, AKOS005391978, NCGC00016619-01, NCGC00017169-01, DA-48866, CAS-2984-97-0, CS-0255452, Q27287343, Isoquinoline,-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydro,, (S)-6,7-dimethoxy-l-methyl-1,2,3,4-tetrahydroisoquinoline, (R,S)-6,7-Dimethoxy-1-methyl-1,2,3,4-tetrahydro-isoquinoline |
|---|---|
| Topological Polar Surface Area | 30.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 15.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 210.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline |
| Prediction Hob | 1.0 |
| Target Id | NPT210 |
| Xlogp | 1.7 |
| Molecular Formula | C12H17NO2 |
| Prediction Swissadme | 1.0 |
| Inchi Key | HMYJLVDKPJHJCF-QMMMGPOBSA-N |
| Fcsp3 | 0.5 |
| Logs | -0.884 |
| Rotatable Bond Count | 2.0 |
| Logd | 1.341 |
| Compound Name | Salsolidine |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 207.126 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 207.126 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 207.27 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.3411925999999994 |
| Inchi | InChI=1S/C12H17NO2/c1-8-10-7-12(15-3)11(14-2)6-9(10)4-5-13-8/h6-8,13H,4-5H2,1-3H3/t8-/m0/s1 |
| Smiles | C[C@H]1C2=CC(=C(C=C2CCN1)OC)OC |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Salsola Collina (Plant) Rel Props:Source_db:cmaup_ingredients