Confluentic acid

Inquiry

For Research Use Only.

Category

Phenols

Cat.No.

NP4587

CAS

6009-12-7

Product Name

Confluentic acid

Structure

Product Details

Description

It is produced by the strain of lichens Lecidea confluens, Pertusaria tuberculifera and P. globularis. It is also isolated from L. tumida, L. macrocarpa and Herpothallon sanguineum.

Synonyms

NSC 249982; Benzoic acid, 2-hydroxy-4-methoxy-6-(2-oxoheptyl)-, 4-carboxy-3-methoxy-5-pentylphenyl ester; 2-Hydroxy-4-methoxy-6-(2-oxoheptyl)benzoic acid 4-carboxy-3-methoxy-5-pentylphenyl ester; 2-Methoxy-4-[2-(2-oxoheptyl)-4-methoxy-6-hydroxybenzoyloxy]-6-pentylbenzoic acid; Confluentinsaeure; Confluentin

IUPAC Name

4-[2-hydroxy-4-methoxy-6-(2-oxoheptyl)benzoyl]oxy-2-methoxy-6-pentylbenzoic acid

Molecular Weight

500.58

Molecular Formula

C28H36O8

Canonical SMILES

CCCCCC1=C(C(=CC(=C1)OC(=O)C2=C(C=C(C=C2O)OC)CC(=O)CCCCC)OC)C(=O)O

InChI

InChI=1S/C28H36O8/c1-5-7-9-11-18-14-22(17-24(35-4)26(18)27(31)32)36-28(33)25-19(13-20(29)12-10-8-6-2)15-21(34-3)16-23(25)30/h14-17,30H,5-13H2,1-4H3,(H,31,32)

InChIKey

UANVCGQMNRTKGM-UHFFFAOYSA-N

Boiling Point

651.8°C at 760 mmHg

Melting Point

157°C

Purity

≥95%

Density

1.173 g/cm3

Solubility

Soluble in Acetone, Chloroform, Dichloromethane, DMSO, Ethyl Acetate

Appearance

Needles

Storage

Store at -20°C

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