 |
| Ligand Name: L-sulforaphane |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB1060 |
PubChem:
9577379
|
Synonym(s):
- (r)-sulforaphane
- 142825-10-3
- (-)-sulforaphane
- (r)-1-isothiocyanato-4-(methylsulfinyl)butane
- 4-methylsulfinylbutyl isothiocyanate
- 1-isothiocyanato-4-[(r)-methylsulfinyl]butane
- unii-ga49j4310u
- chebi:47808
- ga49j4310u
- 4-isothiocyanatobutyl methyl (r)-sulfoxide
- (l)-sulforaphane
- schembl105203
- butane, 1-isothiocyanato-4-(methylsulfinyl)-, (r)-
- chembl128136
- dtxsid40162196
- hms3871l13
- zinc3875035
- hy-13755a
- akos017343745
- acn-035508
- db12422
- l-sulforaphane, >=95% (hplc), oil
- ncgc00165894-01
- as-56554
- cs-0020628
- q27120804
- unii-41684wl1gl component suvmjbtufcvsad-snvbaglbsa-n
show 26 synonym(s)
|
| DrugBank: DB12422 |
ChEMBL: CHEMBL128136 |
| Canonical SMILES: C[S@@](=O)CCCCN=C=S |
| Standard InChI: InChI=1S/C6H11NOS2/c1-10(8)5-3-2-4-7-6-9/h2-5H2,1H3/t10-/m1/s1 |
| Molecular Formula: C6H11NOS2 |
Mol. Weight: 177.02821 |
logP: 1.2479 |
| HBD: 0 | HBA: 3 |
| #Rotatable Bonds: 5 | TPSA: 29.43 |