Broussonetine J2
AlkaPlorer ID: AK017583
Synonym: '(+)-Broussonetine J2'
IUPAC Name: (2R,3R,4R,5R)-2-[(7S,8S)-7,8-dihydroxy-8-[(2R)-piperidin-2-yl]octyl]-5-(hydroxymethyl)pyrrolidine-3,4-diol
Structure
SMILES: OC[C@H]1N[C@H](CCCCCC[C@H](O)[C@@H](O)[C@H]2CCCCN2)[C@@H](O)[C@@H]1O
InChI: InChI=1S/C18H36N2O5/c21-11-14-18(25)17(24)13(20-14)8-3-1-2-4-9-15(22)16(23)12-7-5-6-10-19-12/h12-25H,1-11H2/t12-,13-,14-,15+,16+,17-,18-/m1/s1
InChIKey: ZKIXVIVMKROOOR-DOLDXLAHSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Broussonetia papyrifera | Broussonetia | Moraceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 360.49500000000006
TPSA？: 125.21
MolLogP？: -0.7545999999999984
Number of H-Donors: 7
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|