3-Hydroxy-6-(methylthio)hexyl glucosinolate
AlkaPlorer ID: AK301594
Synonym: None
IUPAC Name: None
Structure
SMILES: CSCCCC(O)CC/C(=N\OS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1O
InChI: InChI=1S/C14H27NO10S3/c1-26-6-2-3-8(17)4-5-10(15-25-28(21,22)23)27-14-13(20)12(19)11(18)9(7-16)24-14/h8-9,11-14,16-20H,2-7H2,1H3,(H,21,22,23)/b15-10+
InChIKey: HIJXEWKOXQGKSZ-XNTDXEJSSA-N
Reference
CAS: 827322-01-0
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Erysimum rhaeticum | Erysimum | Brassicaceae | Brassicales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 465.5680000000001
TPSA？: 186.34
MolLogP？: -1.0632999999999997
Number of H-Donors: 6
Number of H-Acceptors: 12
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|