Details of Natural Product (NP)

General Information of Natural Product (ID: NP1953)
  Natural Product Name
Xanthoxylin + Alpha-Thujene
  Synonyms
Xanthoxylin; 90-24-4; Xanthoxyline; 2'-Hydroxy-4',6'-dimethoxyacetophenone; Brevifolin; 1-(2-Hydroxy-4,6-dimethoxyphenyl)ethanone; 2-Hydroxy-4,6-dimethoxyacetophenone; Brevifolin (Zanthoxylum); 1-(2-Hydroxy-4,6-dimethoxyphenyl)ethan-1-one; Phloracetophenone dimethyl ether; Brevifolin (VAN); 2,4-Di-O-methylphloroacetophenone; 4,6-Dimethoxy-2-hydroxyacetophenone; Phloroacetophenone 2,4-dimethyl ether; UNII-Z8RSY5TZPA; Ethanone, 1-(2-hydroxy-4,6-dimethoxyphenyl)-; Acetophenone der.; 4',6'-dimethoxy-2'-hydroxyacetophenone; 1-Acetyl-2-hydroxy-4,6-dimethoxybenzene; Z8RSY5TZPA; NSC 17392; CHEBI:10070; MFCD00017243; 2-Hydroxyl-4,6-dimethoxy-acetophenone; 1-(2-hydroxy-4,6-dimethoxy-phenyl)ethanone; Acetophenone, 2'-hydroxy-4',6'-dimethoxy-; Ethanone,1-(2-hydroxy-4,6-dimethoxyphenyl)-; Acetophenone, 2'-hydroxy-4',6'-dimethoxy- (8CI); 6-Methoxypaeonol; EINECS 201-978-3; Spectrum_000577; SpecPlus_000713; AI3-26010; Spectrum2_000463; Spectrum3_000181; Spectrum4_001499; Spectrum5_000237; Acetophenone,6'-dimethoxy-; SCHEMBL44708; BSPBio_001701; KBioGR_002137; KBioSS_001057; SPECTRUM200441; MLS002207182; DivK1c_006809; SPBio_000566; 2-Acetyl-3,5-dimethoxyphenol; CHEMBL450288; KBio1_001753; KBio2_001057; KBio2_003625; KBio2_006193; KBio3_001201; DTXSID10237981; ZINC157077; HY-N1063; NSC17392; CCG-38702; NSC-17392; s4781; 2-Hydroxy-4, 6-dimethoxyacetophenone; 4, 6-Dimethoxy-2-hydroxyacetophenone; AKOS015856339; MCULE-4292389127; SDCCGMLS-0066937.P001; 2'-hyroxy-4',6'-dimethoxyacetophenone; NCGC00095824-01; NCGC00095824-02; AC-35124; AS-40799; SMR001306755; SY048579; 2'-Hydroxy-4',6'-dimethoxy-Acetophenone; (2-hydroxy-4,6-dimethoxy-phenyl)-ethanone; 1-(2-hydroxy-4,6-dimethoxyphenyl)-ethanone; 1-(2-Hydroxy-4,6-dimethylphenyl)-ethanone; CS-0016347; D2683; FT-0612544; 1-(2-Hydroxy-4,6-dimethoxyphenyl)ethanone #; 2'-Hydroxy-4',6'-dimethoxyacetophenone, 97%; A843476; AQ-358/42007313; SR-05000002434; 2''-HYDROXY-4'',6''-DIMETHOXYACETOPHENONE; SR-05000002434-1; BRD-K12260308-001-02-6; BRD-K12260308-001-04-2; Q18210424; 2 inverted exclamation mark -Hydroxy-4 inverted exclamation mark ,6 inverted exclamation mark -dimethoxyacetophenone; 2 inverted exclamation marka-Hydroxy-4 inverted exclamation marka,6 inverted exclamation marka-dimethoxyacetophenone
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  Formula C10H12O4
  Weight 196.2
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C10H12O4/c1-6(11)10-8(12)4-7(13-2)5-9(10)14-3/h4-5,12H,1-3H3
  InChI Key FBUBVLUPUDBFME-UHFFFAOYSA-N
  Isomeric SMILES CC(=O)C1=C(C=C(C=C1OC)OC)O
  Canonical SMILES CC(=O)C1=C(C=C(C=C1OC)OC)O
  External Links PubChem ID 66654
CAS ID 90-24-4
NPASS ID NPC305518
HIT ID C0488
CHEMBL ID CHEMBL450288
  NP Activity Charts   Click to show/hide
  Activity Info  

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Satureja cuneifolia
  Factor Name: Developmental Stage Variation [1]
              Species Info Factor Info
               Experiment Detail
Satureja cuneifolia Ten. growing wild in Middle Anatolian provinces of Turkey were collected at various growth stages: a =from Konya, collected in June, before flowering; b = from Konya, collected in July, from flowering plants; c =from Konya, collected in August, full-bloom plants.
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               Factor Function
In the oils of S. cuneifolia, 38 compounds were identified, with thymol (43.6-65.5%), carvacrol (4.7-31.2%), gamma-terpinene (trace-13.7%) and p-cymene (trace-11.5%) being dominant.
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               Factor Part Location NP Content
 
Aerial part: Full Blooming stage
 Aerial parts Middle Anatolia, Turkey
NP Content: 0.1 %
 
Aerial part: Flowering stage
 Aerial parts Middle Anatolia, Turkey
NP Content: 0.3 %
References
1 Essential Oils of Four Turkish Wild-Growing Labiatae Herbs: Salvia cryptantha Montbr. et Auch., Satureja cuneifolia Ten., Thymbra spicata L. and Thymus cilicicus Boiss. et Bal.