Details of Natural Product (NP)

General Information of Natural Product (ID: NP0604)
  Natural Product Name
Hexyl Angelate
  Synonyms
hexyl angelate; 65652-33-7; n-hexyl angelate; SCHEMBL5508660; DTXSID00886780; ZINC20231721; (Z)-2-Methyl-2-butenoic acid hexyl ester; Q67879917
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  Formula C11H20O2
  Weight 184.27
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C11H20O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5H,4,6-9H2,1-3H3/b10-5-
  InChI Key JTCIUOKKVACNCK-YHYXMXQVSA-N
  Isomeric SMILES CCCCCCOC(=O)/C(=C\\C)/C
  Canonical SMILES CCCCCCOC(=O)C(=CC)C
  External Links PubChem ID 22297788
CAS ID 65652-33-7

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Chamaemelum nobile
  Factor Name: Locality Variation [1]
              Species Info Factor Info
               Experiment Detail
Two different Roman chamomile oils were obtained from Giardino Officinale in Casola Valsenio (RA - Italy). One oil was distilled from chamomile plants grown in the Emilia-Romagna region (E), and the other one came from the Piemonte region (P) in Northern Italy
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               Factor Function
No significant differences were found in the composition of the two oils which were characterized by a high content of isobutyl angelate (36.3-38.5%), 2-methylbutyl angelate (18.2-20.3%) and other angelate esters.
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               Factor Part Location NP Content
 
Locality: Emilia-Romagna region, Italy
 Whole plant Italy
NP Content: 0.1 %
 
Locality: Piemonte region, Italy
 Whole plant Italy
NP Content: 0.1 %
References
1 Study on Roman Chamomile (Chamaemelum nobile L. All.) Oil