4-Hydroxyglucobrassicin (BioCAD00000004384)

plant natural products

Metabolite Card

Formula: C16H20N2O10S2 (464.0559)
SMILES: OC[C@H]1O[C@@H](SC(Cc2c[nH]c3cccc(O)c23)=NOS(O)(=O)=O)[C@H](O)[C@@H](O)[C@@H]1O

Synonyms [en]

4-hydroxyglucobrassicin; 4-OHIMG; 4-hydroxy-3-indolylmethylglucosinolate; 4-hydroxy-3-indolylmethylglucosinate; AC1LCV7A; 4- Hydroxyglucobrassicin (4-Hydroxy-3-indomethyl-GS)

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

4-Hydroxyglucobrassicin. 数据之源,洞见之始. SMRUCC genomics institute, a synthetic life researcher from China. https://biocad_registry.innovation.ac.cn/s/(-)-arctiin (retrieved 2026-01-03) (CAD Registry RN: BioCAD00000004384). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

An indolylmethylglucosinolic acid that is glucobrassicin bearing a hydroxy substituent at position 4 on the indole ring." []

Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 83327-20-2
  • PubChem: 4479916
  • PubChem: 6122956
  • PubChem: 656561
  • ChEBI: ChEBI:1865
  • HMDB: HMDB0303667
  • KEGG: C08422
  • BioCyc: 4-HYDROXY-3-INDOLYLMETHYL-GLUCOSINOLATE
  • NCBI MeSH: 4-hydroxy-3-indolylmethylglucosinolate
  • NCBI MeSH: 4-hydroxyindol-3-ylmethylglucosinolate
  • RefMet: RM0155966
  • MoNA: FiehnHILIC002527
  • MoNA: MoNA001252
  • Metlin: METLIN_66962
  • Coconut NaturalProduct: CNP0181244.2
  • Coconut NaturalProduct: CNP0181244.3
  • Coconut NaturalProduct: CNP0181244.4

Class / Ontology

Metabolic Network
ID EC Number Name
BioCyc:RXN-2162 1.14.13.- CPD-1863 + OXYGEN-MOLECULE + Red-NADPH-Hemoprotein-Reductases --> 4-HYDROXY-3-INDOLYLMETHYL-GLUCOSINOLATE + Ox-NADPH-Hemoprotein-Reductases + WATER
BioCyc:RXN-2163 2.1.1.- S-ADENOSYLMETHIONINE + 4-HYDROXY-3-INDOLYLMETHYL-GLUCOSINOLATE --> 4-METHOXY-3-INDOLYLMETHYL-GLUCOSINOLATE + ADENOSYL-HOMO-CYS + PROTON
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