Details of Natural Product (NP)

General Information of Natural Product (ID: NP1057)
  Natural Product Name
3-Methylbutyl 2-Methylbutanoate
  Synonyms
27625-35-0; 3-Methylbutyl 2-methylbutanoate; Isoamyl 2-methylbutyrate; Butanoic acid, 2-methyl-, 3-methylbutyl ester; Isopentyl 2-methylbutyrate; 3-Methylbutyl 2-methylbutyrate; Isopentyl 2-methylbutanoate; 3-Methylbutyl methylbutyrate; Isoamyl 2-methylbutanoate; iso-Amyl 2-methyl butyrate; Isoamyl alpha-methylbutyrate; Fema 3505; 3-Methylbutyl-2-methyl-butyrate; FEMA No. 3505; EINECS 248-581-1; EINECS 298-375-0; 93803-99-7; 3-Methylbutyl 2-methylbutanoate (natural); AI3-33629; isoamyl 2-methyl butyrate; SCHEMBL891188; DTXSID90865387; CHEBI:179544; 2-Methylbutyric acid isopentyl ester; LMFA07010757; AKOS024437763; AS-75501; Butanoic acid,2-methyl-,3-methylbutyl ester; FT-0627325; 3-Methylbutyl 2-methylbutanoate >=98%, FG; 3-Methylbutyl 2-methylbutanoate, >=98%, FG; D97785; J-640434; J-800455; Q27268520; 3-Methylbutyl 2-methylbutanoate, natural, 70% 3-methylbutyl 2-methylbutanoate basis
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  Formula C10H20O2
  Weight 172.26
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C10H20O2/c1-5-9(4)10(11)12-7-6-8(2)3/h8-9H,5-7H2,1-4H3
  InChI Key VGIRHYHLQKDEPP-UHFFFAOYSA-N
  Isomeric SMILES CCC(C)C(=O)OCCC(C)C
  Canonical SMILES CCC(C)C(=O)OCCC(C)C
  External Links PubChem ID 520326
CAS ID 27625-35-0

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Mentha piperita
  Factor Name: Cultivar Comparison [1]
              Species Info Factor Info
               Experiment Detail
Dry leaves of Menlba piperita L. 'Kliment-63' and 'Zefir' of 1997 crop were used.
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               Factor Function
The oil yield from 'Zefir' was 0.97% and that from 'Kliment-63' was 0.54%. The oil from 'Zefir' was found to be rich in menthol (46.2-50.2%) and menthyl acetate (16.8-22.5%). In the oil from 'Kliment-63,' the content of these components was lower, while the menthone content was higher (20.0-23.1%).
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               Factor Part Location NP Content
 
Mentha piperita cv. Zefir
 Leaves Bulgaria
NP Content: 0.1 %
References
1 A Comparative Investigation on the Essential Oil Composition of Two Bulgarian Cultivars of Mentha piperita L.