Acronycidine
PubChem CID: 95708
Connections displayed (default: 10).
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| Compound Synonyms | Acronycidine, 521-43-7, 4,5,7,8-tetramethoxyfuro[2,3-b]quinoline, 5,7,8-Trimethoxydictamnine, Furo(2,3-b)quinoline, 4,5,7,8-tetramethoxy-, BRN 0302664, 4,5,7,8-Tetramethoxyfuro(2,3-b)quinoline, CHEBI:2436, 4,5,7,8-tetramethoxy-furo[2,3-b]quinoline, C15H15NO5, DTXSID10200099, 4-27-00-02314 (Beilstein Handbook Reference), NSC 30619, Furo[2,3-b]quinoline, 4,5,7,8-tetramethoxy-, Trimethoxydictamnine, 5,7,8-, DTXCID60122590, NSC30619, NSC-30619, AKOS040754652, PD151306, Q27105666 |
|---|---|
| Topological Polar Surface Area | 63.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 21.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 355.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 4,5,7,8-tetramethoxyfuro[2,3-b]quinoline |
| Prediction Hob | 1.0 |
| Xlogp | 2.8 |
| Molecular Formula | C15H15NO5 |
| Prediction Swissadme | 1.0 |
| Inchi Key | XTCGYRFLVLFRGW-UHFFFAOYSA-N |
| Fcsp3 | 0.2666666666666666 |
| Logs | -3.029 |
| Rotatable Bond Count | 4.0 |
| Logd | 2.867 |
| Compound Name | Acronycidine |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 289.095 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 289.095 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 289.28 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.5979746380952378 |
| Inchi | InChI=1S/C15H15NO5/c1-17-9-7-10(18-2)14(20-4)12-11(9)13(19-3)8-5-6-21-15(8)16-12/h5-7H,1-4H3 |
| Smiles | COC1=CC(=C(C2=C1C(=C3C=COC3=N2)OC)OC)OC |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Acronychia Baueri (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Cephalotaxus Mannii (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Galium Aparine (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Limonium Bicolor (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Sarcomelicope Argyrophylla (Plant) Rel Props:Source_db:cmaup_ingredients