glucocochlearin
AlkaPlorer ID: AK007886
Synonym: '1-Methylpropyl glucosinolate', 'sec-butylglucosinolate', 'glucocochlearin(1-)', '1-methylpropylglucosinolate', 'sec-Butyl glucosinolate', 'Glucocochlearin', 'Glucojiabutin'
IUPAC Name: [(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E,2R)-2-methyl-N-sulfooxybutanimidothioate
Structure
SMILES: CC[C@@H](C)/C(=N/OS(=O)(=O)O)S[C@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@H]1O
InChI: InChI=1S/C11H21NO9S2/c1-3-5(2)10(12-21-23(17,18)19)22-11-9(16)8(15)7(14)6(4-13)20-11/h5-9,11,13-16H,3-4H2,1-2H3,(H,17,18,19)/b12-10-/t5-,6-,7+,8-,9-,11-/m1/s1
InChIKey: TUSWQPFNQXCPGB-KCKZBJOHSA-N
Reference
Glucosinolates in Tersonia brevipes (Gyrostemonaceae)
PubChem CID: 154496674
LOTUS: LTS0005012
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Moringa peregrina | Moringa | Moringaceae | Brassicales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 375.4210000000001
TPSA？: 166.11
MolLogP？: -1.3015
Number of H-Donors: 5
Number of H-Acceptors: 10
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|