Details of Natural Product (NP)

General Information of Natural Product (ID: NP0608)
  Natural Product Name
2-Methylpropyl 3-Hydroxy-2-Methylidenebutanoate
  Synonyms
2-methylpropyl 3-hydroxy-2-methylidenebutanoate; CHEBI:171944; Isobutyl 2-(1-hydroxyethyl)acrylate #; Isobutyl 3-hydroxy-2-methylenebutanoate; 3-Hydroxy-2-methylenebutyric acid isobutyl ester; 80758-68-5
Click to Show/Hide
  Formula C9H16O3
  Weight 172.22
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C9H16O3/c1-6(2)5-12-9(11)7(3)8(4)10/h6,8,10H,3,5H2,1-2,4H3
  InChI Key YWLLUDSCDSOEDO-UHFFFAOYSA-N
  Isomeric SMILES CC(C)COC(=O)C(=C)C(C)O
  Canonical SMILES CC(C)COC(=O)C(=C)C(C)O
  External Links PubChem ID 546207
CAS ID 80758-68-5

 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
Click to Show/Hide
               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.
Click to Show/Hide
               Factor Part Location NP Content
 
Locality: Emilia-Romagna region, Italy
 Whole plant Italy
NP Content: 0.3 %
 
Locality: Piemonte region, Italy
 Whole plant Italy
NP Content: 0.3 %
References
1 Study on Roman Chamomile (Chamaemelum nobile L. All.) Oil