2,6-bis(hydroxymethyl)-1-methylpiperidine-3,4,5-triol
AlkaPlorer ID: AK064136
Synonym: None
IUPAC Name: (2R,3S,5R,6R)-2,6-bis(hydroxymethyl)-1-methylpiperidine-3,4,5-triol
Structure
SMILES: CN1[C@H](CO)[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO
InChI: InChI=1S/C8H17NO5/c1-9-4(2-10)6(12)8(14)7(13)5(9)3-11/h4-8,10-14H,2-3H2,1H3/t4-,5-,6-,7+,8+/m1/s1
InChIKey: CVSZHOAOIZMVHV-YQXRAVKXSA-N
Reference
α-Glucosidase-inhibitory iminosugars from the leaves of Suregada glomerulata
LOTUS: LTS0017054
NPASS: NPC163134
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Suregada glomerulata | Suregada | Euphorbiaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 207.226
TPSA？: 104.39
MolLogP？: -3.2637
Number of H-Donors: 5
Number of H-Acceptors: 6
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Maltase-glucoamylase | IC50 | 60.0 | nM | 10.1021/jm970836l |
| Mus musculus | Mus musculus | Activity | 114.0 | mg/dl | 10.1016/j.bmc.2013.07.048 |
| Mus musculus | Mus musculus | Activity | 115.6 | mg/dl | 10.1016/j.bmc.2013.07.048 |
| Mus musculus | Mus musculus | Activity | 121.4 | mg/dl | 10.1016/j.bmc.2013.07.048 |
| Mus musculus | Mus musculus | Activity | 141.0 | mg/dl | 10.1016/j.bmc.2013.07.048 |
| Mus musculus | Mus musculus | Activity | 141.2 | mg/dl | 10.1016/j.bmc.2013.07.048 |
| Mus musculus | Mus musculus | Activity | 144.8 | mg/dl | 10.1016/j.bmc.2013.07.048 |
| Mus musculus | Mus musculus | AUC | 2278000.0 | ng.hr.mL-1 | 10.1016/j.bmc.2013.07.048 |
| Mus musculus | Mus musculus | AUC | 2723000.0 | ng.hr.mL-1 | 10.1016/j.bmc.2013.07.048 |
| Rattus norvegicus | Acidic alpha-glucosidase | IC50 | 20.0 | nM | 10.1021/jm970836l |
| Rattus norvegicus | Acidic alpha-glucosidase | IC50 | 170.0 | nM | 10.1021/jm970836l |
| Rattus norvegicus | Acidic alpha-glucosidase | IC50 | 1000.0 | nM | 10.1021/jm970836l |
| Rattus norvegicus | Acidic alpha-glucosidase | IC50 | 2800.0 | nM | 10.1021/jm970836l |
| Rattus norvegicus | Acidic alpha-glucosidase | IC50 | 50000.0 | nM | 10.1021/jm970836l |
| None | Unchecked | IC50 | 80.0 | nM | 10.1016/j.bmc.2013.07.048 |