Molecule

2,5-bis(hydroxymethyl)-3,4-dihydroxypyrrolidine

AlkaPlorer ID: AK019529

Synonym: '2,5-Dihydroxymethyl-3,4-dihydroxypyrrolidine', 'DMDP', '2R,5R-Dihydroxymethyl-3R,4R-dihydroxy-pyrrolidine', '2,5-Dideoxy-2,5-imino-D-glucitol', '(+)-2,5-Dideoxy-2,5-imino-D-mannitol', '(+)-2,5-Dideoxy-2,5-imino-D-glucitol'

IUPAC Name: (2S,3S,4S,5S)-2,5-bis(hydroxymethyl)pyrrolidine-3,4-diol

Structure

SMILES: OC[C@@H]1N[C@@H](CO)[C@H](O)[C@H]1O

InChI: InChI=1S/C6H13NO4/c8-1-3-5(10)6(11)4(2-9)7-3/h3-11H,1-2H2/t3-,4-,5-,6-/m0/s1

InChIKey: PFYHYHZGDNWFIF-BXKVDMCESA-N

Reference

2,5-Dihydroxymethyl 3,4-dihydroxypyrrolidine dans les feuilles de Derris elliptica

PubChem CID: 11073745

LOTUS: LTS0176241

SuperNatural Ⅲ: SN0284371-01

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain

Properties Information

Molecule Weight: 163.173

TPSA？: 92.95

MolLogP？: -2.9667999999999988

Number of H-Donors: 5

Number of H-Acceptors: 5

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Canavalia ensiformis	Alpha-mannosidase	Inhibition	50.0	%	10.1016/j.bmc.2016.10.015
Homo sapiens	Beta-glucosidase cytosolic	Inhibition	nan	%	10.1016/j.bmc.2022.117129
Homo sapiens	Glycogen debranching enzyme	IC50	nan	None	10.1016/j.bmc.2008.01.032
Homo sapiens	Lysosomal alpha-glucosidase	Activity	60.0	%	10.1016/j.bmc.2022.117129
Homo sapiens	Lysosomal alpha-glucosidase	Activity	80.0	%	10.1016/j.bmc.2022.117129
Homo sapiens	Lysosomal alpha-glucosidase	Delta Tm	0.0	degrees C	10.1016/j.bmc.2022.117129
Homo sapiens	Lysosomal alpha-glucosidase	Delta Tm	8.3	degrees C	10.1016/j.bmc.2022.117129
Homo sapiens	Lysosomal alpha-glucosidase	Delta Tm	13.9	degrees C	10.1016/j.bmc.2022.117129
Homo sapiens	Lysosomal alpha-glucosidase	FC	2.0	None	10.1016/j.bmc.2022.117129
Homo sapiens	Lysosomal alpha-glucosidase	Ki	6400.0	nM	10.1016/j.bmc.2022.117129
Homo sapiens	Lysosomal alpha-glucosidase	Tm	65.0	degrees C	10.1016/j.bmc.2022.117129
Rattus norvegicus	Acidic alpha-glucosidase	IC50	1200.0	nM	10.1021/jm301304e
Rattus norvegicus	Sucrase-isomaltase	IC50	40.0	nM	10.1016/j.bmc.2008.01.032
Rattus norvegicus	Sucrase-isomaltase	IC50	100.0	nM	10.1016/j.bmc.2008.01.032
Rattus norvegicus	Sucrase-isomaltase	IC50	620.0	nM	10.1021/jm301304e
Rattus norvegicus	Sucrase-isomaltase	IC50	770.0	nM	10.1021/jm301304e
Rattus norvegicus	Sucrase-isomaltase	IC50	1400.0	nM	10.1016/j.bmc.2008.01.032
None	Fibroblast	Activity	nan	None	10.1016/j.bmc.2022.117129
None	Unchecked	IC50	1500.0	nM	10.1016/j.bmc.2008.01.032
None	Unchecked	IC50	70000.0	nM	10.1016/j.bmc.2008.01.032
None	Unchecked	Inhibition	50.0	%	10.1016/j.bmc.2008.01.032
None	Unchecked	Inhibition	50.0	%	10.1016/j.bmc.2016.10.015
None	Unchecked	Inhibition	nan	%	10.1016/j.bmc.2022.117129