Alliin (BioCAD00000006139)

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Metabolite Card

Formula: C6H11NO3S (177.046)
SMILES: NC(CS(=O)CC=C)C(O)=O

Synonyms [en]

alliin; 3-(Allylsulphinyl)-L-alanine; (+)-L-Alliin; (R)C(S)S-Alliin; 2-amino-3-prop-2-enylsulinylpropanoic acid; 2-amino-3-prop-2-enylsulfinylpropanoic acid

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

Alliin. 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: BioCAD00000006139). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

(R)C(S)S-Alliin is found in garden onion. (R)C(S)S-Alliin is a constituent of garlic oil (Allium sativum), also from ramsons (Allium ursinum).

Cytoplasm Extracellular
Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 17795-26-5
  • CAS Registry Number: 17795-27-6
  • CAS Registry Number: 556-27-4
  • PubChem: 121922
  • PubChem: 15558642
  • PubChem: 87310
  • PubChem: 9576089
  • ChEBI: ChEBI:173816
  • ChEBI: ChEBI:182413
  • ChEBI: ChEBI:2596
  • HMDB: HMDB0033592
  • HMDB: HMDB0301759
  • KEGG: C08265
  • BioCyc: CPD-9269
  • NCBI MeSH: alliin
  • Wikipedia: Alliin
  • RefMet: RM0137181
  • MoNA: Bruker_HCD_library001101
  • MoNA: KO002188
  • MoNA: KO002189
  • MoNA: KO002190
  • MoNA: KO002191
  • MoNA: KO002192
  • MoNA: VF-NPL-LTQ002550
  • MoNA: VF-NPL-QEHF008251
  • MoNA: VF-NPL-QEHF008252
  • MoNA: VF-NPL-QEHF008253
  • MoNA: VF-NPL-QEHF008254
  • MoNA: VF-NPL-QEHF008255
  • MoNA: VF-NPL-QEHF008256
  • MoNA: VF-NPL-QEHF008257
  • MoNA: VF-NPL-QEHF008258
  • MoNA: VF-NPL-QEHF008259
  • MoNA: VF-NPL-QEHF008260
  • MoNA: VF-NPL-QEHF008261
  • MoNA: VF-NPL-QEHF008262
  • MoNA: VF-NPL-QEHF008263
  • MoNA: VF-NPL-QEHF008264
  • MoNA: VF-NPL-QEHF008265
  • Metlin: METLIN_66873
  • Coconut NaturalProduct: CNP0583631.1
  • Coconut NaturalProduct: CNP0583631.2
  • Coconut NaturalProduct: CNP0583631.3

Class / Ontology

Metabolic Network
ID EC Number Name
BioCyc:RXN-8905 1.14.13.- CPD-9298 + OXYGEN-MOLECULE + NADPH + PROTON --> CPD-9269 + WATER + NADP
BioCyc:RXN-8898 4.4.1.4 CPD-9269 --> CPD-9273 + 2-AMINOACRYLATE
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