Details of Natural Product (NP)

General Information of Natural Product (ID: NP1071)
  Natural Product Name
Dibutyl Phthalate
  Synonyms
dibutyl phthalate; 84-74-2; Di-n-butyl phthalate; n-Butyl phthalate; Butyl phthalate; Celluflex DPB; Genoplast B; Palatinol C; Polycizer DBP; Unimoll DB; Elaol; Staflex DBP; Dibutyl-o-phthalate; Witcizer 300; Ergoplast FDB; Kodaflex DBP; DIBUTYLPHTHALATE; Hexaplas M/B; dibutyl benzene-1,2-dicarboxylate; Phthalic acid dibutyl ester; Dibutyl 1,2-benzenedicarboxylate; 1,2-Benzenedicarboxylic acid, dibutyl ester; DBP (ester); N-Butylphthalate; dibutyl-phthalate; Ersoplast FDA; Phthalate, di-n-butyl; Uniflex DBP; Hatcol DBP; Dibutyl o-phthalate; RC Plasticizer DBP; Benzene-o-dicarboxylic acid di-n-butyl ester; Phthalic acid, dibutyl ester; o-Benzenedicarboxylic acid, dibutyl ester; RCRA waste number U069; PX 104; ortho-Dibutyl phthalate; Phthalic acid di-n-butyl ester; Di-n-butylorthophthalate; Dibutyl-1,2-benzenedicarboxylate; Dibutylphthatlate; Palatinol DBP; Dibutyl phthalated; NSC 6370; di-n-butyl phthalate (DBuP); UNII-2286E5R2KE; 1,2-Benzenedicarboxylic acid, 1,2-dibutyl ester; Morflex 240; Uniplex 150; Di-n-butylester kyseliny ftalove; CHEBI:34687; o-Benzenedicarboxylic acid dibutyl ester; 1,2-Benzenedicarboxylic acid dibutyl ester; CHEMBL272485; DTXSID2021781; Benzene-o-dicarboxylic acid, di-n-butyl ester; 2286E5R2KE; NSC-6370; Benzenedicarboxylic acid dibutyl ester; MFCD00009441; 1,2-dibutyl benzene-1,2-dicarboxylate; DSSTox_CID_1781; Dibutyl ester of 1,2-benzenedicarboxylic acid; DSSTox_RID_76324; DSSTox_GSID_21781; Phthalate, dibutyl-; Caswell No. 292; nutyl phthalate; dibutyl phthalate (DBP); Phthalate, Butyl; CAS-84-74-2; Phthalate, Dibutyl; CCRIS 2676; HSDB 922; Di n Butyl Phthalate; RAPIDCELLtrade markP; Dibutyl phthalate [NF]; SR-05000001549; EINECS 201-557-4; RCRA waste no. U069; EPA Pesticide Chemical Code 028001; BRN 1914064; Di-n-butylester kyseliny ftalove [Czech]; Bufa; Monocizer dbp; Plasthall dbp; Vestinol c; Hatco dbp; AI-3-00283; Dibutyll phthalate; Ruifeng vp 201; Corflex 440; Benzenedicarboxylic acid, dibutyl ester; Spectrum_001975; Yh-1bd2; Di(1-butyl) phthalate; SpecPlus_000628; Dibutyl phthalate, 99%; Spectrum3_000874; Spectrum4_000714; Spectrum5_002068; Epitope ID:138714; EC 201-557-4; WLN: 4OVR BVO2; Dibutyl phthalate, >=99%; SCHEMBL24051; BSPBio_002547; KBioGR_001267; KBioSS_002541; SPECTRUM330086; MLS002177802; BIDD:ER0641; DivK1c_006724; Phthalic acid, bis-butyl ester; GTPL6295; KBio1_001668; KBio2_002532; KBio2_005100; KBio2_007668; KBio3_002047; Vp-201; NSC6370; Dibutyl phthalate, AR, >=99%; Dibutyl phthalate, LR, >=98%; Dibutyl 1, 2-benzenedicarboxylate; HMS2091E09; HMS3041E18; Pharmakon1600-00330086; BCP24796; HY-Y0304; ZINC1693431; Dibutyl phthalate, Selectophore(TM); Tox21_201729; Tox21_300980; BBL011532; BDBM50371946; NSC755894; STL146650; AKOS005720807; CCG-230933; DB13716; MCULE-8727957434; NSC-755894; NCGC00090769-01; NCGC00090769-02; NCGC00090769-03; NCGC00090769-04; NCGC00090769-05; NCGC00090769-06; NCGC00090769-07; NCGC00090769-08; NCGC00090769-09; NCGC00254882-01; NCGC00259278-01; SMR000777923; SBI-0052568.P002; CS-0013564; Dibutyl phthalate, ReagentPlus(R), >=99%; FT-0624680; P0292; S5377; Dibutyl phthalate, SAJ special grade, >=98.0%; Q415612; J-503795; SR-05000001549-1; SR-05000001549-3; Araldite(R) resins(modified epoxy resins),grade 502; BRD-K73477617-001-01-0; BRD-K73477617-001-04-4; Dibutyl phthalate, PESTANAL(R), analytical standard; F0001-2134; Z277540112; Dibutyl phthalate, certified reference material, TraceCERT(R); Dibutyl phthalate, European Pharmacopoeia (EP) Reference Standard; Dibutyl phthalate, United States Pharmacopeia (USP) Reference Standard; Dibutyl Phthalate, Pharmaceutical Secondary Standard; Certified Reference Material
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  Formula C16H22O4
  Weight 278.34
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3
  InChI Key DOIRQSBPFJWKBE-UHFFFAOYSA-N
  Isomeric SMILES CCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC
  Canonical SMILES CCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC
  External Links PubChem ID 3026
CAS ID 84-74-2
NPASS ID NPC10251
HIT ID C0014
CHEMBL ID CHEMBL272485
  NP Activity Charts   Click to show/hide
  Activity Info  

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Fragaria vesca
  Factor Name: Cultivar Comparison [1]
              Species Info Factor Info
               Experiment Detail
Whole leaves and inflorescences of two wild strawberry cultivars ('Rugia' and 'Baron von Solemacher') harvested in 2008 during the agrotechnical experiment performed by Department of Vegetable and Medicinal Plants, University of Life Sciences in Lublin, were used as a material for determinations. Samples were collected before noon at sunny and dry days at the beginning of wild strawberry's flowering stage. Material was dried up to 35 ℃ in shadow and air just after the harvest.
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               Factor Function
Depending on a cultivar, air-dry inflorescences from wild strawberry contain from 0.21% ('Baron von Solemacher' cv.) to 0.30% ('Rugia' cv.), whereas leaves contains from 0.46% ('Baron von Solemacher' cv.) to 0.62% ('Rugia' cv.) of essential oils. GC/MS analysis of essential oils achieved from studied materials revealed presence of 70 (including 59 identified) compounds in leaves of 'Rugia' cv. and 58 (including 50 identified) compounds in leaves of 'Baron von Solemacher' cv. Essential oils from inflorescences of 'Rugia' cv. contained 52 (including 47 identified), while 'Baron von Solemacher' cv. contained 54 (including 46 identified) compounds. The chromatographic analyses by GC-MS revealed that myrthenol, nonal, linalool and phthalide dibuthyl dominated in essential oils obtained from leaves, while myrthenol, citronelol, linalool and geraniol - from those of inflorescences. There were qualitative differences between oil components at both studied materials and differentiation between both cultivars, as well.
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               Factor Part Location NP Content
 
Inflorescence: Fragaria vesca cv. Baron von Solemacher
 Inflorescence Poland
NP Content: 12.43 %
 
Inflorescence: Fragaria vesca cv. Rugia
 Inflorescence Poland
NP Content: 14.93 %
 
Leaf: Fragaria vesca cv. Baron von Solemacher
 Leaves Poland
NP Content: 12 %
 
Leaf: Fragaria vesca cv. Rugia
 Leaves Poland
NP Content: 6.34 %
References
1 Contents and chemical composition of essential oils from wild strawberry (Fragaria vesca L.)