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479-20-9,MFCD00016597
Catalog No.:AA00373M

479-20-9 | Benzoic acid,3-formyl-2,4-dihydroxy-6-methyl-,3-hydroxy-4-(methoxycarbonyl)-2,5-dimethylphenyl ester

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1mg
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5mg
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10mg
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00373M
Chemical Name:
Benzoic acid,3-formyl-2,4-dihydroxy-6-methyl-,3-hydroxy-4-(methoxycarbonyl)-2,5-dimethylphenyl ester
CAS Number:
479-20-9
Molecular Formula:
C19H18O8
Molecular Weight:
374.3414
MDL Number:
MFCD00016597
SMILES:
COC(=O)c1c(C)cc(c(c1O)C)OC(=O)c1c(C)cc(c(c1O)C=O)O
Properties
Properties
 
Form:
Solid  
MP:
156-158℃  

Computed Properties
 
Complexity:
564  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
6  
XLogP3:
4.3  

Downstream Synthesis Route
479-20-9    75843-51-5   
C31H34N2O9 

[1]Alam,Mahboob;Chavasiri,Warinthorn;Duong,Thuc-Huy;Huynh,Ngoc-Vinh;Nguyen,Huu-Hung;Nguyen,Thi-Phuong;Nguyen,Tien-Cong;ParamitaDevi,Asshaima;Phan,Hoang-Vinh-Truong;Sichaem,Jirapast;Tran,Hoai-Duc;Tran,Nguyen-Minh-An[Bioorganicandmedicinalchemistryletters,2020,vol.30,#17]

Literature

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Journal: Phytomedicine : international journal of phytotherapy and phytopharmacology 20121015

Title: Lichen secondary metabolites are responsible for induction of apoptosis in HT-29 and A2780 human cancer cell lines.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20120401

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Journal: Journal of agricultural and food chemistry 20110323

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Journal: Toxicology in vitro : an international journal published in association with BIBRA 20110301

Title: Physiological responses of root-less epiphytic plants to acid rain.

Journal: Ecotoxicology (London, England) 20110301

Title: Variable responses of different human cancer cells to the lichen compounds parietin, atranorin, usnic acid and gyrophoric acid.

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Journal: PloS one 20110101

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Journal: International journal of molecular sciences 20110101

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Journal: Indian journal of dermatology 20110101

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Journal: Phytomedicine : international journal of phytotherapy and phytopharmacology 20100401

Title: Light screening in lichen cortices can be quantified by chlorophyll fluorescence techniques for both reflecting and absorbing pigments.

Journal: Planta 20100401

Title: Antinociceptive activity of atranorin in mice orofacial nociception tests.

Journal: Zeitschrift fur Naturforschung. C, Journal of biosciences 20100101

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Journal: Fitoterapia 20090701

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Journal: Natural product communications 20090701

Title: Protein tyrosine phosphatase 1B inhibitory effects of depsidone and pseudodepsidone metabolites from the Antarctic lichen Stereocaulon alpinum.

Journal: Bioorganic & medicinal chemistry letters 20090515

Title: Characterization of a non-reducing polyketide synthase gene from lichen Dirinaria applanata.

Journal: Phytochemistry 20090401

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Journal: Contact dermatitis 20090201

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Journal: Biological & pharmaceutical bulletin 20081001

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Journal: Journal of chromatography. A 20080222

Title: Light might regulate divergently depside and depsidone accumulation in the lichen Parmotrema hypotropum by affecting thallus temperature and water potential.

Journal: Mycologia 20080101

Title: Ozone reactivity and free radical scavenging behavior of phenolic secondary metabolites in lichens exposed to chronic oxidant air pollution from Mexico City.

Journal: Journal of chemical ecology 20070801

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Journal: Molecules (Basel, Switzerland) 20070515

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Journal: Molecules (Basel, Switzerland) 20070512

Title: Metabolites from the Lichen Ochrolechia parella growing under two different heliotropic conditions.

Journal: Journal of natural products 20070201

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Journal: Journal of chemical ecology 20070101

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Journal: Zeitschrift fur Naturforschung. C, Journal of biosciences 20070101

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Journal: Contact dermatitis 20060401

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Journal: Mycologia 20060101

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Journal: Chemistry & biodiversity 20050101

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Journal: Journal of structural biology 20040601

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Journal: Journal of structural biology 20040601

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Journal: Mycological research 20040501

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Title: Antimycobacterial activity of lichen metabolites in vitro.

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Title: Zhou R, et al. The lichen secondary metabolite atranorin suppresses lung cancer cell motility and tumorigenesis. Sci Rep. 2017 Aug 15;7(1):8136.

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SDS
Tags:479-20-9 Molecular Formula|479-20-9 MDL|479-20-9 SMILES|479-20-9 Benzoic acid,3-formyl-2,4-dihydroxy-6-methyl-,3-hydroxy-4-(methoxycarbonyl)-2,5-dimethylphenyl ester