Details of Natural Product (NP)

General Information of Natural Product (ID: NP0292)
  Natural Product Name
4-Isopropylbenzyl Acetate
  Synonyms
Cuminyl acetate; 4-Isopropylbenzyl acetate; 59230-57-8; p-Isopropylbenzyl acetate; (4-propan-2-ylphenyl)methyl acetate; Benzenemethanol, 4-(1-methylethyl)-, acetate; p-Cymen-7-ol acetate; Benzenemethanol, 4-(1-methylethyl)-, 1-acetate; CUMINYLACETATE; EINECS 261-671-5; BRN 1950785; 4-(1-Methylethyl)benzenemethanol acetate; p-Cymene-7-ol acetate; Cuminic alcohol, acetate; 3-06-00-01912 (Beilstein Handbook Reference); SCHEMBL873057; DTXSID0052259; ZINC410078; AKOS024323718; MCULE-3264164572; [4-(propan-2-yl)phenyl]methyl acetate; ACETIC ACID 4-ISOPROPYLBENZYL ESTER; Q63398877
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  Formula C12H16O2
  Weight 192.25
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C12H16O2/c1-9(2)12-6-4-11(5-7-12)8-14-10(3)13/h4-7,9H,8H2,1-3H3
  InChI Key QBCRVYRADYXNOW-UHFFFAOYSA-N
  Isomeric SMILES CC(C)C1=CC=C(C=C1)COC(=O)C
  Canonical SMILES CC(C)C1=CC=C(C=C1)COC(=O)C
  External Links PubChem ID 100990
CAS ID 59230-57-8

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Salvia euphratica
  Factor Name: Variety Comparison [1]
              Species Info Factor Info
               Experiment Detail
Aerial parts of both varieties(Salvia euphratica Montbret et Aucher ex Benth. var. euphratica and Salvia euphratica Montbret et Aucher ex Benth. var. leiocalycina) were collected in Malatya, Turkey in June 1999.
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               Factor Function
Ninety-five compounds in var. euphratica and 94 compounds in var. leiocalycina were characterized representing 93% and 95% of the total components detected, respectively, with 1,8-cineole (13.8% and 15.2%) and myrtenyl acetate (15.9% and 13.9%) as main constituents.
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               Factor Part Location NP Content
 
Salvia euphratica var. euphratica
 Flowering aerial parts Turkey
NP Content: 0.5 %
 
Salvia euphratica var. leiocalycina
 Flowering aerial parts Turkey
NP Content: 0.4 %
References
1 The Essential Oils of Two Varieties of Salvia euphratica Montbret et Aucher ex Benth. var. euphratica and var. leiocalycina (Rech. fil.) Hedge from Turkey