Oxyphysodic acid

Oxyphysodic acid

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Oxyphysodic acid
Category Others
Catalog number BBF-05442
CAS 53899-46-0
Molecular Weight 486.51
Molecular Formula C26H30O9

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Specification

Synonyms Physodol; 3-Hydroxyphysodic acid; 3,9,10-trihydroxy-6-oxo-7-(2-oxoheptyl)-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid; 11H-Dibenzo(b,e)(1,4)dioxepin-11-one, 2,4,8-trihydroxy-1-(2-oxoheptyl)-6-pentyl-
IUPAC Name 3,4,8-trihydroxy-11-oxo-1-(2-oxoheptyl)-6-pentyl-11H-dibenzo[b,e][1,4]dioxepine-7-carboxylic acid
Canonical SMILES CCCCCC1=C(C(=CC2=C1OC3=C(C(=CC(=C3O)O)CC(=O)CCCCC)C(=O)O2)O)C(=O)O
InChI InChI=1S/C26H30O9/c1-3-5-7-9-15(27)11-14-12-18(29)22(30)24-20(14)26(33)34-19-13-17(28)21(25(31)32)16(23(19)35-24)10-8-6-4-2/h12-13,28-30H,3-11H2,1-2H3,(H,31,32)
InChI Key BQHHNAPTXQOPBW-UHFFFAOYSA-N

Properties

Boiling Point 735.1°C at 760 mmHg
Density 1.332 g/cm3

Reference Reading

1. Metabolites of Pseudevernia furfuracea (L.) Zopf. and their inhibition potential of proteolytic enzymes
B Proksa, J Adamcová, M Sturdíková, J Fuska Pharmazie. 1994 Apr;49(4):282-3.
Atranorin (1), physodic acid (2), oxyphysodic acid (3) and virensic (4) acid were identified in P. furfuracea, a lichen species collected in West Tatra. According to HPLC analysis contents of these metabolites in dried material was 0.11-0.19% (1), 1.46-3.78% (2), 1.69 to 3.44% (3), 1.14-1.46% (4). Atranorin was the strongest inhibitor of trypsin as well as of the porcine pancreatic elastase.

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Tip: Chemical formula is case sensitive. C22H30N4O c22h30n40
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