2-Methylpropyl glucosinolate

AlkaPlorer ID: AK021047

Synonym: 'Isobutyl glucosinolate'

IUPAC Name: [(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-3-methyl-N-sulfooxybutanimidothioate

Structure

SMILES: CC(C)C/C(=N/OS(=O)(=O)O)S[C@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@H]1O

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InChI: InChI=1S/C11H21NO9S2/c1-5(2)3-7(12-21-23(17,18)19)22-11-10(16)9(15)8(14)6(4-13)20-11/h5-6,8-11,13-16H,3-4H2,1-2H3,(H,17,18,19)/b12-7-/t6-,8-,9-,10+,11+/m0/s1

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InChIKey: SKLKAEFXBVWMJP-MOPFWBRRSA-N

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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

Metabolism Information