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Atranorin

Atranorin structure

CAS No:
479-20-9
Formula:
C19H18O8
Chemical Name:
Atranorin
Synonyms:
Benzoic acid,3-formyl-2,4-dihydroxy-6-methyl-,3-hydroxy-4-(methoxycarbonyl)-2,5-dimethylphenyl ester;Atranoric acid;Isophthalaldehydic acid,2,4-dihydroxy-6-methyl-,4-ester with methyl 3,6-dimethyl-β-resorcylate;Atranorin;Atranorine;Parmelin;Parmelin acid;Usnarin;Usnarin acid;NSC 685591;NSC 249980;NSC 87512;Antranorin
Categories:
Natural Products > Phenols

Description

Atranorin is a lichen secondary metabolite. Atranorin inhibits lung cancer cell motility and tumorigenesis by affecting AP-1, Wnt, and STAT signaling and suppressing RhoGTPase activity[1][2].

Atranorin is a carbonyl compound.

Atranorin Basic Attributes

Molecular Weight：

374.34

Exact Mass：

374.34

EC Number：

207-527-7

UNII：

450U2VJ2VG

NSC Number：

685591|249980|87512

DSSTox ID：

DTXSID10197319

Characteristics

PSA：

130

XLogP3：

6.14

Density：

1.4±0.1 g/cm3

Melting Point：

195 °C

Boiling Point：

535.7±50.0 °C at 760 mmHg

Flash Point：

189.3±23.6 °C

Refractive Index：

1.644

Vapor Pressure：

4.34E-12mmHg at 25°C

Toxicity：

skn-gpg 5% CODEDG 11,168,1984

Drug Information

MeSH Entry Terms：

atranorin

Atranorin Use and Manufacturing

antinociceptive, antiinflammatory, antibacterial

Computed Properties

Molecular Weight:374.3
XLogP3:4.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:374.10016753
Monoisotopic Mass:374.10016753
Topological Polar Surface Area:130
Heavy Atom Count:27
Complexity:564
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Atranorin

CAS No.: 479-20-9

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