alpha-5-C-(3-hydroxybutyl)-hyacinthacine A2
AlkaPlorer ID: AK041058
Synonym: None
IUPAC Name: (1R,2R,3R,5S,8R)-5-(3-hydroxybutyl)-3-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1,2-diol
Structure
SMILES: CC(O)CC[C@@H]1CC[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)N12
InChI: InChI=1S/C12H23NO4/c1-7(15)2-3-8-4-5-9-11(16)12(17)10(6-14)13(8)9/h7-12,14-17H,2-6H2,1H3/t7?,8-,9-,10-,11-,12-/m1/s1
InChIKey: CGZUVSCEWJVPBT-LVZGIILASA-N
Reference
Isolation of Glycosidase-Inhibiting Hyacinthacines and Related Alkaloids from <i>Scilla socialis</i>
PubChem CID: 16737241
LOTUS: LTS0054462
NPASS: NPC473419
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Scilla peruviana | Scilla | Hyacinthaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 245.319
TPSA？: 84.16
MolLogP？: -0.9232999999999998
Number of H-Donors: 4
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bos taurus | Alpha-L-fucosidase 1 | Inhibition | 50.0 | % | 10.1021/np0499721 |
| Bos taurus | Beta-galactosidase | Inhibition | 50.0 | % | 10.1021/np0499721 |
| Bos taurus | Beta-galactosidase | Inhibition | 50.0 | % | 10.1021/np0700826 |
| Caldicellulosiruptor saccharolyticus (strain ATCC 43494 / DSM 8903) | Beta-galactosidase | Inhibition | 50.0 | % | 10.1021/np0700826 |
| Coffea arabica | Alpha-galactosidase | Inhibition | 50.0 | % | 10.1021/np0499721 |
| Coffea arabica | Alpha-galactosidase | Inhibition | 50.0 | % | 10.1021/np0700826 |
| Homo sapiens | Alpha-L-fucosidase I | Inhibition | 50.0 | % | 10.1021/np0700826 |
| Homo sapiens | Beta-glucocerebrosidase | Inhibition | 50.0 | % | 10.1021/np0499721 |
| Rattus norvegicus | Acidic alpha-glucosidase | Inhibition | 50.0 | % | 10.1021/np0499721 |
| Rattus norvegicus | Beta-mannosidase | Inhibition | 50.0 | % | 10.1021/np0499721 |
| None | Unchecked | IC50 | 49000.0 | nM | 10.1021/np0499721 |
| None | Unchecked | IC50 | 136000.0 | nM | 10.1021/np0499721 |
| None | Unchecked | IC50 | 180000.0 | nM | 10.1021/np0700826 |
| None | Unchecked | Inhibition | 50.0 | % | 10.1021/np0499721 |
| None | Unchecked | Inhibition | 50.0 | % | 10.1021/np0700826 |