Details of Natural Product (NP)

General Information of Natural Product (ID: NP0186)
  Natural Product Name
Acetal
  Synonyms
Acetal; 1,1-DIETHOXYETHANE; 105-57-7; Diethyl acetal; Acetaldehyde diethyl acetal; Ethane, 1,1-diethoxy-; Ethylidene diethyl ether; Diaethylacetal; Diethylacetal; Acetale; Acetal diethylique; 1,1-Dietossietano; Acetaal; 1,1-Diethoxy-ethaan; 1,1-Diaethoxy-aethan; Acetaldehyde, diethyl acetal; Ethane, diethoxy-; Ethylidenediethyl ether; Acetaldehyde ethyl acetal; USAF DO-45; 1,1-diethoxy-ethane; Capsicum annuum l; NSC 7624; UNII-5G14F9E2HB; 1,1-Diethoxyacetal; Diethoxy-1,1-ethane; Ethylidine diethyl ether; acetaldehyde diethylacetal; CH3CH(OC2H5)2; 5G14F9E2HB; Acetal (Acetaldehyde diethyl acetal); NCGC00091076-01; Acetaal [Dutch]; Acetal (natural); DSSTox_CID_10607; DSSTox_RID_78853; DSSTox_GSID_30607; Acetale [Italian]; diethoxyethane; polyacetal; Diaethylacetal [German]; Acetal diethylique [French]; CAS-105-57-7; 1,1-Dietossietano [Italian]; 1,1-Diethoxy-ethaan [Dutch]; FEMA No. 2002; 1,1-Diaethoxy-aethan [German]; HSDB 1635; EINECS 203-310-6; Ethane, 1,1-diethoxy-, homopolymer; UN1088; BRN 1098310; diethoxy-ethane; Acetal Natural; Acetal resin; Cadco acetal; AI3-24135; Diethyl Aceta; Acetron GP; Aceton NS; Delrin AF Blend; Acetal (VAN); MFCD00009243; 1,1-diethoxy ethane; Delrin 100ST; Delrin 150SA; Delrin 500T; Delrin 550SA; Acetal [UN1088] [Flammable liquid]; Delrin 100; Delrin 107; Delrin 500; Delrin 507; Delrin 570; Delrin 900; Diaethylacetal(german); Ethanal diethyl acetal; Ethylene diethyl ether; 1, 1-Diethoxyethane; Acetal homopolymer resin; Thermocomp KB-1008; SCHEMBL9459; Acetal, >=98%, FG; AT-20GF; Delrin 100AF, 500AF; CHEMBL1338583; DTXSID6030607; FEMA 2002; Acetal, natural, FG, >=97%; NSC7624; WLN: 2OY1 & O2; 1, 1-Diaethoxy-aethan(GERMAN); Acetaldehyde diethyl acetal, 99%; CHEBI:179533; ZINC404268; NSC-7624; Electrafil J-80/CF/10/TF/10; Tox21_111078; Tox21_200274; BBL011492; STL146604; AKOS005721110; MCULE-7152410134; UN 1088; Acetal [UN1088] [Flammable liquid]; NCGC00091076-02; NCGC00257828-01; VS-02960; DB-040634; N,N-Diethyl-N,N-dibenzyl ammonium chloride; D0455; FT-0606113; EN300-20127; Acetaldehyde diethyl acetal, analytical standard; Q410938; SR-01000944353; J-001450; J-803005; SR-01000944353-1; Acetaldehyde diethylacetal 100 microg/mL in Acetonitrile; F8880-7267; Z1258578254
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  Formula C6H14O2
  Weight 118.17
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C6H14O2/c1-4-7-6(3)8-5-2/h6H,4-5H2,1-3H3
  InChI Key DHKHKXVYLBGOIT-UHFFFAOYSA-N
  Isomeric SMILES CCOC(C)OCC
  Canonical SMILES CCOC(C)OCC
  External Links PubChem ID 7765
CAS ID 105-57-7
NPASS ID NPC184593
CHEMBL ID CHEMBL1338583
  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. Cabernet Sauvignon
 Pomaces Italy
NP Content: 21.95 %
 
Vitis vinifera var. Cabernet Sauvignon
 Stalks Italy
NP Content: < 0.05 %
 
Vitis vinifera var. Frappato
 Pomaces Italy
NP Content: 28.59 %
 
Vitis vinifera var. Nerello Mascalese
 Pomaces Italy
NP Content: 10.59 %
 
Vitis vinifera var. Nero d'Avola
 Pomaces Italy
NP Content: 6.07 %
 
Vitis vinifera var. Nero d'Avola
 Stalks Italy
NP Content: 1.18 %
References
1 Volatile components of grape pomaces from different cultivars of Sicilian Vitis vinifera L.