Romucosine H
PubChem CID: 78385443
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| Compound Synonyms | Romucosine H, N-Methoxycarbonylnorisocorydine |
|---|---|
| Topological Polar Surface Area | 77.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Inchi Key | JWSAYTXQWHOMHU-UHFFFAOYSA-N |
| Rotatable Bond Count | 4.0 |
| Synonyms | N-Methoxycarbonylnorisocorydine, Romucosine H |
| Heavy Atom Count | 28.0 |
| Compound Name | Romucosine H |
| Description | Alkaloid from Annona cherimola (cherimoya). Romucosine H is found in cherimoya and fruits. |
| Exact Mass | 385.153 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 385.153 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 573.0 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 385.4 |
| Database Name | fooddb_chem_all;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | methyl 11-hydroxy-1,2,10-trimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-carboxylate |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Inchi | InChI=1S/C21H23NO6/c1-25-14-6-5-11-9-13-16-12(7-8-22(13)21(24)28-4)10-15(26-2)20(27-3)18(16)17(11)19(14)23/h5-6,10,13,23H,7-9H2,1-4H3 |
| Smiles | COC1=C(C2=C(CC3C4=C2C(=C(C=C4CCN3C(=O)OC)OC)OC)C=C1)O |
| Xlogp | 2.9 |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C21H23NO6 |
- 1. Outgoing r'ship
FOUND_INto/from Annona Cherimola (Plant) Rel Props:Source_db:fooddb_chem_all