2-Hydroxyethyl glucosinolate
AlkaPlorer ID: AK030841
Synonym: ''
IUPAC Name: [(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-3-hydroxy-N-sulfooxypropanimidothioate
Structure
SMILES: O=S(=O)(O)O/N=C(/CCO)S[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
InChI: InChI=1S/C9H17NO10S2/c11-2-1-5(10-20-22(16,17)18)21-9-8(15)7(14)6(13)4(3-12)19-9/h4,6-9,11-15H,1-3H2,(H,16,17,18)/b10-5-/t4-,6+,7+,8-,9-/m1/s1
InChIKey: RFCSADBEYPEEKD-IONXGPLESA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Capparis spinosa | Capparis | Capparaceae | Brassicales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 363.366
TPSA？: 186.34
MolLogP？: -2.965199999999999
Number of H-Donors: 6
Number of H-Acceptors: 11
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|