Molecule

Radicamine A

AlkaPlorer ID: AK016731

Synonym: '(+)-Radicamine A', 'Radicamine A'

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

SMILES: COC1=CC=C([C@@H]2N[C@@H](CO)[C@H](O)[C@H]2O)C=C1O

InChI: InChI=1S/C12H17NO5/c1-18-9-3-2-6(4-8(9)15)10-12(17)11(16)7(5-14)13-10/h2-4,7,10-17H,5H2,1H3/t7-,10-,11-,12-/m0/s1

InChIKey: NEAQPVOYHYPSER-BVALORAHSA-N

PubChem CID: 10083681

SuperNatural Ⅲ: SN0242897-04

NPASS: NPC160931

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Artemisia carvifolia	Artemisia	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Euphorbia jolkinii	Euphorbia	Euphorbiaceae	Malpighiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Aquilegia vulgaris	Aquilegia	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Adansonia digitata	Adansonia	Malvaceae	Malvales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Lobelia chinensis	Lobelia	Campanulaceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 255.27

TPSA？: 102.18

MolLogP？: -0.8722000000000001

Number of H-Donors: 5

Number of H-Acceptors: 6

RingCount: 2

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Bos taurus	Alpha-L-fucosidase 1	IC50	41000.0	nM	10.1016/j.ejmech.2020.112034
Canavalia ensiformis	Alpha-mannosidase	IC50	28000.0	nM	10.1016/j.ejmech.2020.112034
Homo sapiens	Maltase-glucoamylase	IC50	6700.0	nM	10.1016/j.ejmech.2020.112034
None	Unchecked	IC50	25210.0	nM	10.1016/j.ejmech.2020.112034
None	Unchecked	IC50	113000.0	nM	10.1016/j.bmc.2008.10.063
None	Unchecked	IC50	200000.0	nM	10.1016/j.bmc.2008.10.063