Details of Natural Product (NP)

General Information of Natural Product (ID: NP0555)
  Natural Product Name
Methylisoeugenol
  Synonyms
Methylisoeugenol; trans-Methylisoeugenol; Methyl isoeugenol; Isomethyleugenol; 6379-72-2; 93-16-3; Isoeugenol methyl ether; 4-Propenylveratrole; Isohomogenol; 4-trans-Propenylveratrole; trans-4-Propenylveratrole; 1-Veratryl-1-propene; trans-isomethyleugenol; (E)-Methyl isoeugenol; Isoeugenyl methyl ether; UNII-J6M6C71VVR; 1,2-Dimethoxy-4-propenylbenzene; Benzene, 1,2-dimethoxy-4-(1-propenyl)-; O-Methylisoeugenol; 1,2-dimethoxy-4-[(E)-prop-1-enyl]benzene; Benzene, 1,2-dimethoxy-4-propenyl; Benzene, 1,2-dimethoxy-4-propenyl-; 4-(1-Propenyl)-1,2-dimethoxybenzene; 1,2-dimethoxy-4-[(1E)-prop-1-en-1-yl]benzene; 3,4-Dimethoxypropenylbenzene; J6M6C71VVR; CHEBI:6877; (E)-1,2-Dimethoxy-4-(prop-1-en-1-yl)benzene; Benzene, 1,2-dimethoxy-4-(1E)-1-propenyl-; cis-Methylisoeugenol; 1,3,4-Isoeugenol methyl ether; 4-Propenyl-1,2-dimethoxybenzene; Veratrole, 4-propenyl-; 1,2-dimethoxy-4-(prop-1-en-1-yl)benzene; 1-(3,4-Dimethoxyphenyl)-1-propene; TRIDEUTEROMETHYLISOEUGENOL; NSC 46111; 1-Propene, 1-(3,4-dimethoxyphenyl)-; 1,2-Dimethoxy-4-[1-propenyl]benzene #; Benzene, 4-(1-propenyl)-1,2-dimethoxy; 1,2-DIMETHOXY-4-(1-PROPENYL)BENZENE; Benzene, 1,2-dimethoxy-4-(1-propen-1-yl)-; 6380-24-1; Methylisoeugenol, (E)-; EINECS 228-958-7; BRN 1911285; Benzene, 1,2-dimethoxy-4-propenyl-, (E)-; O-Methyl Isoeugenol; (e)-methylisoeugenol; Methyl IsoEugenol Natural; 1,4-Isoeugenol methyl ether; ghl.PD_Mitscher_leg0.366; 1-Propene,4-dimethoxyphenyl)-; CHEMBL465829; WLN: 2U1R CO1 DO1; CHEBI:14469; Benzene,2-dimethoxy-4-propenyl-; Methyl isoeugenol, >=98%, FG; ZINC404370; NSC46111; BBL009809; MFCD00009282; NSC-46111; s3006; STK801268; AKOS005608367; Benzene,2-dimethoxy-4-(1-propenyl)-; 1,2-Dimethoxy-4-propenylbenzene, 99%; 1,2-dimethoxy-4-prop-1-en-1-ylbenzene; 54349-79-0; AS-56928; M582; VS-02193; 4-(1-Propenyl)pyrocatechol Dimethyl Ether; (E)-1,2-dimethoxy-4-(prop-1-enyl)benzene; CS-0022657; P1103; (E)-1,2-DIMETHOXY-4-(1-PROPENYL)BENZENE; W-100250; Q10858039; Q27108981; UNII-46RN7Q97DE component NNWHUJCUHAELCL-SNAWJCMRSA-N; BENZENE,1,2-DIMETHOXY,4-PROPENYL ISOEUGENOL,METHYL ETHER
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  Formula C11H14O2
  Weight 178.23
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3/b5-4+
  InChI Key NNWHUJCUHAELCL-SNAWJCMRSA-N
  Isomeric SMILES C/C=C/C1=CC(=C(C=C1)OC)OC
  Canonical SMILES CC=CC1=CC(=C(C=C1)OC)OC
  External Links PubChem ID 637776
CAS ID 6379-72-2
NPASS ID NPC310905
CHEMBL ID CHEMBL465829
  NP Activity Charts   Click to show/hide
  Activity Info  

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Ducrosia anethifolia
  Factor Name: Locality Variation [1]
              Species Info Factor Info
               Experiment Detail
The aerial parts of Ducrosia anethifolia (DC.) Boiss. were collected in the wild from Mehdi Abad (Kerman province, in southern Iran) at the flowering stage in June 2006. The material was dried at room temperature.
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               Factor Function
The 63 components of this interesting plant were identified in the oil of D. anethifolia, representing 94.0% of the oil. alpha-Pinene (11.6%), terpinolene(3.2%) and (z)-beta-ocimene (2.8%) were the main hydrocarbon components present in the oil, while decanal (54.0%), cis-chrysanthenyl acetate(3.2%) and decanoic acid (1.3%) were the major oxygen-containing constituents.
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               Factor Part Location NP Content
 
Locality: Larestan, Iran
 Aerial parts Iran
NP Content: 1 %
 
Locality: Kerman, Iran
 Aerial parts Iran
NP Content: 0.2 %
      Species Name: Ducrosia assadii
  Factor Name: Locality Variation [2]
              Species Info Factor Info
               Experiment Detail
The aerial parts of D. assadii Alava. were collected in the wild from Lalehzar (Kerman Province, in southern Iran) at the flowering stage, in July 2007. The material was dried at room temperature and used for distillation. Distillation: A direct-fired field distillation unit containing a distillation tank (capacity: 1,000 L), a condensation column and receiver, all made of stainless steel, and which can process 30-50 kg of dried aerial parts from the plants/batch, was installed at an altitude of 2600 m (boiling point: 87 ℃). Dried aerial parts from the plants (40 kg) were charged into the distillation unit along with 500 L fresh water and the unit was heated by steam. The system was kept open to atmospheric pressure until the temperature reached to 70 ℃, when the air present in the unit was replaced by the vapor. After complete removal of air from the unit, the air vent was closed and the whole unit was operated as a closed system under pressure to distill the oil. The pressure, temperature and rate of distillation were controlled manually. The process was completed after the collection of 500 L of water distillate. The oil collected in the receiver and dried over anhydrous Na2SO4. Extraction of Ducrosia Second Oil From Ducrosia Water by Redistillation: The seprated distillate water collected in the receiver was redistilled in a 1,000 L still to yield more Doucrosia oil (this oil is known as secondary essential oil, second oil, cooked oil or indirect oil).
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               Factor Function
Fifty components were identified in a second oil of D. assadii from Lalehzar with decanal (35.2%), nonadecane (12%) and citronellyl acetate (11.6%) as the main constituents. The oil from Dehbakrii also contained decanal (36.4%) as the main component of an oil recovered from the distillate water. The results showed that the amount of decanal is remarkably high in the oils of D. assadii.
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               Factor Part Location NP Content
 
Locality: Lalehzar, Kerman Province, southern Iran
 Aerial parts Iran
NP Content: 0.2 %
References
1 Chemical Composition of the Essential Oil of Ducrosia anethifolia (DC.) Boiss. from Kerman Province in Iran
2 Chemical Composition of the Essential Oil of Ducrosia assadii Alava. from Kerman Province in Iran