Hexyl butyrate (BioCAD00000030609)

feces plant natural products

Metabolite Card

Formula: C10H20O2 (172.1463)
SMILES: CCCCCCOC(=O)CCC

Synonyms [en]

HEXYL BUTYRATE; hexyl butanoate; n-Hexyl n-butanoate; n-Hexyl butyrate; Butyric acid, hexyl ester; n-Butyric acid n-hexyl ester

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

Hexyl butyrate. 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: BioCAD00000030609). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

Hexyl butyrate is found in apple. Hexyl butyrate occurs in many fruits.

Extracellular Membrane
Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 2639-63-6
  • PubChem: 17525
  • ChEBI: ChEBI:87559
  • HMDB: HMDB0033620
  • HMDB: HMDB33620
  • LipidMaps: LMFA07010419
  • BioCyc: CPD-22638
  • RefMet: RM0140073
  • MoNA: HMDB0033620_c_ms_101356
  • MoNA: JP006503
  • Metlin: METLIN_89420
  • Coconut NaturalProduct: CNP0153531.0

Class / Ontology

Metabolic Network
ID EC Number Name
Rhea:RHEA:65445 hexan-1-ol + butanoyl-CoA => hexyl butanoate + CoA
Rhea:RHEA:65446 hexyl butanoate + CoA => hexan-1-ol + butanoyl-CoA
Rhea:RHEA:65447 hexan-1-ol + butanoyl-CoA <=> hexyl butanoate + CoA
BioCyc:RXN-21010 1.14.13.- CPD-22637 + NADPH + PROTON + OXYGEN-MOLECULE --> CPD-22638 + NADP + WATER
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