General Information of Natural Product (ID: NP0668)
  Natural Product Name
3-Nonanone
  Synonyms
3-NONANONE; nonan-3-one; 925-78-0; Ethyl hexyl ketone; Ethyl n-hexyl ketone; n-Hexyl ethyl ketone; UNII-00C380UHNL; 00C380UHNL; 3-Nonanone (natural); FEMA No. 3440; Nonanon-3; EINECS 213-125-2; 3-Nonanone, 99%; AI3-36117; SCHEMBL104700; 3-Nonanone, >96%, FG; DTXSID1061289; FEMA 3440; CHEBI:179605; ZINC1850920; 5652AC; LMFA12000053; MFCD00009541; AKOS009158321; 3-Nonanone, analytical reference material; AS-56339; 3-Nonanone, natural (US), >=97%, FG; DB-057312; CS-0330265; FT-0626191; N0253; D91660; Q27231338
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  Formula C9H18O
  Weight 142.24
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C9H18O/c1-3-5-6-7-8-9(10)4-2/h3-8H2,1-2H3
  InChI Key IYTXKIXETAELAV-UHFFFAOYSA-N
  Isomeric SMILES CCCCCCC(=O)CC
  Canonical SMILES CCCCCCC(=O)CC
  External Links PubChem ID 61235
CAS ID 925-78-0

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Thymus leucostomus
  Factor Name: Altitude Variation [1]
              Species Info Factor Info
               Experiment Detail
Herbal parts were collected from A = Eskisehir: Suluagac village in Turkey, altitude 1100 m, in July 1990 and B = Corum: Osmancik, Berk village in Turkey, altitude 580-600 m, on 22 June 1993.
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               Factor Function
One chemotype (Suluagac village, Eskisehir, Turkey) contained carvacrol (21.59%), p-cymene (17.80%) and thymol (14.10%); and the other chemotype (Berk village, Corum, Turkey) contained alpha-terpinyl acetate (23.80%), borneol (12.85%), linalool (13.67%) and thymol (11.31%) as major constituents.
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               Factor Part Location NP Content
 
Locality: Suluagac village, Eskisehir, Turkey; Altitude 1100 m
Herbal parts Turkey
NP Content: 0.03 %
 
Locality: Berk village, Corum, Turkey; Altitude 580-600 m
Herbal parts Turkey
NP Content: 0.05 %
      Species Name: Thymus pseudopulegioides
  Factor Name: Locality Variation [2]
              Species Info Factor Info
               Experiment Detail
Plant materials were collected from the following localities in north western Turkey. A = Trabzon: Caykara, Soganli dag on July 28, 1994; B = Bayburt: Caykara, Mohakambo yaylasi on July 25, 1994; C = Trabzon: Koprubasi, Vizara yaylasi on July 20, 1994.
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               Factor Function
One hundred and four compounds were identified representing 97.5-99.5% of the total components detected in thymol/carvacrol (50.14/10.67%), thymol/linalool (23.14/20.24%) and linalool/alpha-terpinyl acetate/geraniol (21.55/16.70/11.17%) rich oils.
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               Factor Part Location NP Content
 
Locality: Soganli dag, Caykara, Trabzon, Eskisehir, Turkey
Aerial parts Eskisehir, Turkey
NP Content: <0.1 %
      Species Name: Thymus striatus
  Factor Name: Locality Variation [3]
              Species Info Factor Info
               Experiment Detail
Aerial parts of the plant were collected from four localities: A = Kirklareli: Karadere in May 1991; B = Kirklareli: Karahamza Village in May 1990; C = Kirklareli: Evciler Village on 13 June 1993; D = Kirklareli: Korukoy on 25 May 1994
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               Factor Function
The four oils obtained from plants collected in different localities of the same region gave quite different compositions as follows: A: thymol (10.5%), 1,8-cineole (9.96%), p-cymene (9.48%), carvacrol (5.28%); B: beta-caryophyllene (29.50%), carvacrol(20.59%); C: thymol (34.7%), beta-caryophyllene (12.74%), carvacrol (5.24%); D: beta-caryophyllene (56.48%), germacrene D (11.12%), carvacrol (4.85%). Since the identities of the plant materials were checked repeatedly, any misidentification is ruled out. Except for A and C, all the other materials showed beta-caryophyllene as the major constituent. Carvacrol (20.59%) was present in good amount in the oil of B. In A, however, high percentages of 1,8-cineole (10%) and p-cymene (9.5%) were significant. This oil contained only a trace amount of beta-caryophyllene. Four isomeric caryophyllene alcohols were detected in the oil B. The results clearly indicate that the oil of T. striatus var. interruptus has no consistency and we can safely suggest that there are at least three chemotypes, namely thymol/1,8-cineole/p-cymene-type; thymol/beta-caryophyllene-type; and beta-caryophyllene-type, of this species.
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               Factor Part Location NP Content
 
Locality: Karadere, Kirklareli, Turkey
Aerial parts Kirklareli, Turkey
NP Content: 0.2 %
References
1 Essential Oil of Thymus leucostomus Hausskn. et Velen. var. leucostomus
2 Composition of the Essential Oil of Thymus pseudopulegioides Klokov et Des.-Shost from Turkey
3 Essential Oils of Thymus striatus Vahl var. interruptus Jalas from Turkey