Semilepidinoside B
PubChem CID: 131751376
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Semilepidinoside B |
|---|---|
| Topological Polar Surface Area | 137.0 |
| Hydrogen Bond Donor Count | 5.0 |
| Inchi Key | ASPNXCICLVYQCJ-UHFFFAOYSA-N |
| Rotatable Bond Count | 6.0 |
| Synonyms | Semilepidinoside B |
| Heavy Atom Count | 26.0 |
| Compound Name | Semilepidinoside B |
| Description | Alkaloid from the seeds of Lepidium sativum (garden cress). Semilepidinoside B is found in garden cress and brassicas. |
| Exact Mass | 366.143 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 366.143 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 443.0 |
| Hydrogen Bond Acceptor Count | 8.0 |
| Molecular Weight | 366.4 |
| Database Name | fooddb_chem_all;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-(hydroxymethyl)-6-[4-(1H-imidazol-2-ylmethyl)-2-methoxyphenoxy]oxane-3,4,5-triol |
| Total Atom Stereocenter Count | 5.0 |
| Total Bond Stereocenter Count | 0.0 |
| Inchi | InChI=1S/C17H22N2O7/c1-24-11-6-9(7-13-18-4-5-19-13)2-3-10(11)25-17-16(23)15(22)14(21)12(8-20)26-17/h2-6,12,14-17,20-23H,7-8H2,1H3,(H,18,19) |
| Smiles | COC1=C(C=CC(=C1)CC2=NC=CN2)OC3C(C(C(C(O3)CO)O)O)O |
| Xlogp | -0.9 |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C17H22N2O7 |
- 1. Outgoing r'ship
FOUND_INto/from Lepidium Sativum (Plant) Rel Props:Source_db:fooddb_chem_all