(+)-Sophoridine
PubChem CID: 285698
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 83148-91-8, Matridin-15-one, (+)-Matrine, (+)-Sophoridine, Matridin-15-one, (6b,7b,11a)- (9CI), 7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one, .alpha.-Matrine, Matrene, (+)-, d-Sophoridine, 1H,5H,10H-dipyrido[2,1-f:3',2',1'-ij][1,6]naphthyridin-10-one, dodecahydro-, Matridin-15-one, Vegard, alpha-Matrine, Matridin-15-one, (5.beta.,7.beta.,11.alpha.)-, 6-Allomatrine, 6beta-Matrine, Tetrahydroisosophoramine, regid845916, NEW BASE STRUCTURE, 6.beta.,7.beta.-Matrine, Dodecahydro-3a,7a-diaza-benzo[de]anthracen-8-one, Oprea1_680866, Oprea1_860679, MLS000029265, SCHEMBL8260145, CHEMBL1733145, DTXSID20871734, ZSBXGIUJOOQZMP-UHFFFAOYSA-N, HMS1611N16, HMS2269A14, AAA64139, ALBB-020900, MFCD02735434, NSC143088, NSC318810, AKOS000591194, AKOS017259293, NSC-143088, LS-14445, SMR000011610, DB-050311, AB00397099-11, SR-01000601144, Q6787831, SR-01000601144-3 |
|---|---|
| Topological Polar Surface Area | 23.6 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 18.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 356.0 |
| Database Name | cmaup_ingredients;hmdb_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one |
| Prediction Hob | 1.0 |
| Class | Lupin alkaloids |
| Xlogp | 1.6 |
| Superclass | Alkaloids and derivatives |
| Subclass | Matrine alkaloids |
| Molecular Formula | C15H24N2O |
| Prediction Swissadme | 0.0 |
| Inchi Key | ZSBXGIUJOOQZMP-UHFFFAOYSA-N |
| Fcsp3 | 0.9333333333333332 |
| Logs | -1.776 |
| Rotatable Bond Count | 0.0 |
| Logd | 1.123 |
| Synonyms | Matrine, (5beta)-isomer, Matrine, (5b,6b,7b,11a)-Matridin-15-one, (5Β,6β,7β,11α)-matridin-15-one |
| Compound Name | (+)-Sophoridine |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 248.189 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 248.189 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 248.36 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 4.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aliphatic heteropolycyclic compounds |
| Esol | -2.375294 |
| Inchi | InChI=1S/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2 |
| Smiles | C1CC2C3CCCN4C3C(CCC4)CN2C(=O)C1 |
| Nring | 4.0 |
| Defined Bond Stereocenter Count | 0.0 |
| Taxonomy Direct Parent | Matrine alkaloids |
- 1. Outgoing r'ship
FOUND_INto/from Sophora Alopecuroides (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Sophora Flavescens (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Sophora Tonkinensis (Plant) Rel Props:Source_db:cmaup_ingredients