Normelicopine
PubChem CID: 5378229
Connections displayed (default: 10).
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| Compound Synonyms | Normelicopine, O-Normelicopine, 517-76-0, O-Demethylmelicopine, 5-hydroxy-4-methoxy-11-methyl-[1,3]dioxolo[4,5-c]acridin-6-one, DTXSID20418820, 1,3-Dioxolo[4,5-c]acridin-6(11H)-one, 5-hydroxy-4-methoxy-11-methyl-, 5-hydroxy-4-methoxy-11-methyl-(1,3)dioxolo(4,5-c)acridin-6-one, 1,3-Dioxolo(4,5-c)acridin-6(11H)-one, 5-hydroxy-4-methoxy-11-methyl-, NSC103007, NCIOpen2_007055, DTXCID80369667, NSC-103007, 1,5-c]acridin-6(11H)-one, 5-hydroxy-4-methoxy-11-methyl-, 5-Hydroxy-4-methoxy-11-methyl[1,3]dioxolo[4,5-c]acridin-6(11H)-one # |
|---|---|
| Topological Polar Surface Area | 68.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 22.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 458.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 5-hydroxy-4-methoxy-11-methyl-[1,3]dioxolo[4,5-c]acridin-6-one |
| Prediction Hob | 1.0 |
| Xlogp | 3.1 |
| Molecular Formula | C16H13NO5 |
| Prediction Swissadme | 0.0 |
| Inchi Key | GSMOOICPKHHWCP-UHFFFAOYSA-N |
| Fcsp3 | 0.1875 |
| Logs | -4.165 |
| Rotatable Bond Count | 1.0 |
| Logd | 1.534 |
| Compound Name | Normelicopine |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 299.079 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 299.079 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 299.28 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.702357490909091 |
| Inchi | InChI=1S/C16H13NO5/c1-17-9-6-4-3-5-8(9)12(18)10-11(17)14-16(22-7-21-14)15(20-2)13(10)19/h3-6,19H,7H2,1-2H3 |
| Smiles | CN1C2=CC=CC=C2C(=O)C3=C1C4=C(C(=C3O)OC)OCO4 |
| Nring | 6.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Limonium Bicolor (Plant) Rel Props:Source_db:cmaup_ingredients