Details of Natural Product (NP)

General Information of Natural Product (ID: NP0252)
  Natural Product Name
Phenethyl Acetate
  Synonyms
Phenethyl acetate; 2-Phenylethyl acetate; 103-45-7; 2-Phenethyl acetate; Acetic acid, 2-phenylethyl ester; Benzylcarbinyl acetate; beta-Phenylethyl acetate; Acetic Acid Phenethyl Ester; Acetic acid, phenethyl ester; Phenethyl alcohol, acetate; Phenylethyl acetate; Ethanol, 2-phenyl-, acetate; beta-Phenethyl acetate; NSC 71927; 2-Phenylethylacetate; UNII-67733846OW; .beta.-Phenethyl acetate; .beta.-Phenylethyl acetate; Phenylethyl acetate-.beta.; Acetic Acid 2-Phenylethyl Ester; CHEBI:31988; FEMA 2857; Acetic acid beta-phenylethyl ester; 67733846OW; Phenethyl acetate (natural); FEMA No. 2857; EINECS 203-113-5; BRN 0638179; AI3-03878; 2-phenylethyl ester; Acetic acid phenethyl; beta -phenethyl acetate; Phenylethyl acetate-beta; beta -phenylethyl acetate; EC 203-113-5; 2-Phenethyl acetate, 99%; B-PHENYLETHYL ACETATE; DSSTox_CID_24506; DSSTox_RID_80276; NCIOpen2_000347; WLN: 1VO2R; .beta.-Phenylethanol acetate; 2-Phenylethyl acetate, 9CI; DSSTox_GSID_44506; SCHEMBL111422; SCHEMBL8509205; CHEMBL3184025; DTXSID7044506; acetic acid 2-phenyl ethyl ester; 2-PHENYL-ETHANOL, ACETATE; LABOTEST-BB LTBB003410; LABOTEST-BB LTBB004791; ZINC388671; Acetic acid beta -phenylethyl ester; NSC71927; Tox21_301027; Acetic acid .beta.-phenylethyl ester; MFCD00008720; NSC-71927; Phenethyl acetate, analytical standard; AKOS005207039; 2-PHENYLETHYL ESTER ACETIC ACID; AS02439; MCULE-2877884154; Phenethyl acetate, >=98%, FCC, FG; NCGC00248260-01; NCGC00254929-01; AC-18657; BS-42314; CAS-103-45-7; A0692; CS-0154998; FT-0621738; Phenethyl acetate, natural, >=98%, FCC, FG; A851581; Q6856299; W-108850
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  Formula C10H12O2
  Weight 164.2
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C10H12O2/c1-9(11)12-8-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
  InChI Key MDHYEMXUFSJLGV-UHFFFAOYSA-N
  Isomeric SMILES CC(=O)OCCC1=CC=CC=C1
  Canonical SMILES CC(=O)OCCC1=CC=CC=C1
  External Links PubChem ID 7654
CAS ID 103-45-7
NPASS ID NPC170484
CHEMBL ID CHEMBL3184025
  NP Activity Charts   Click to show/hide
  Activity Info  

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Vitis vinifera
  Factor Name: Variety Comparison [1]
              Species Info Factor Info
               Experiment Detail
Grape pomaces and stalks of Nero d'Avola and Frappato were donated by the ''Valle dell'Acate'' wine firm, Acate, RG, Italy - those from Nerello Mascalese and Cabernet Sauvignon were given by the ''Emanuele Scammacca Barone del Murgo'' wine firm, Santa Venerina, CT, Italy. The winemaking procedures were similar for all samples, namely grape clusters were crushed and destemmed using a destemmer-crusher. The crushed grapes were treated with sulphur dioxide (0.2-0.5% total mash) and with selected strains of Saccharomyces cerevisiae to start up the fermentation. After 6-8 days of maceration, when alcoholic fermentation was finished, the mash was pressed. Stalks coming from destemming procedure and grape pomace coming from the maceration procedure were subjected to the distillation procedures within 24 h of their collection. All materials were collected during the 2004 vintage.
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               Factor Function
On the whole, 38 components have been characterized in the samples of grape pomaces, with Frappato cv. showing the richest composition; instead, 88 components have been detected in the stalks of Frappato, Nero d'Avola, Nerello Mascalese and Cabernet Sauvignon varieties.
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               Factor Part Location NP Content
 
Vitis vinifera var. Nero d'Avola
 Stalks Italy
NP Content: 6.04 %
References
1 Volatile components of grape pomaces from different cultivars of Sicilian Vitis vinifera L.