(2S,3S,4S,5R)-2-(hydroxymethyl)-5-methylpyrrolidine-3,4-diol
AlkaPlorer ID: AK026419
Synonym: None
IUPAC Name: (2S,3S,4S,5R)-2-(hydroxymethyl)-5-methylpyrrolidine-3,4-diol
Structure
SMILES: C[C@H]1N[C@@H](CO)[C@H](O)[C@H]1O
InChI: InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(2-8)7-3/h3-10H,2H2,1H3/t3-,4+,5+,6+/m1/s1
InChIKey: YRBKDBZXOAEMOT-VANKVMQKSA-N
Reference
New Sugar-Mimic Alkaloids from the Pods of <i>Angylocalyx pynaertii</i>
PubChem CID: 12085983
CAS: 330594-46-2
LOTUS: LTS0153438
SuperNatural Ⅲ: SN0458016-04
NPASS: NPC30126
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Angylocalyx pynaertii | Angylocalyx | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 147.174
TPSA？: 72.72
MolLogP？: -1.9392
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bos taurus | Alpha-L-fucosidase 1 | IC50 | 1000.0 | nM | 10.1021/np010360f |
| Bos taurus | Alpha-L-fucosidase 1 | Ki | 490.0 | nM | 10.1021/np010360f |
| Bos taurus | Beta-galactosidase | IC50 | 420000.0 | nM | 10.1021/np010360f |
| Coffea arabica | Alpha-galactosidase | Inhibition | 50.0 | % | 10.1021/np010360f |
| Rattus norvegicus | Acidic alpha-glucosidase | Inhibition | 50.0 | % | 10.1021/np010360f |
| Rattus norvegicus | Beta-mannosidase | Inhibition | 50.0 | % | 10.1021/np010360f |
| Rattus norvegicus | Sucrase-isomaltase | Inhibition | 50.0 | % | 10.1021/np010360f |
| None | Unchecked | IC50 | 510000.0 | nM | 10.1021/np010360f |
| None | Unchecked | IC50 | 570000.0 | nM | 10.1021/np010360f |
| None | Unchecked | Inhibition | 50.0 | % | 10.1021/np010360f |