NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
2-hydroxy-4-(2-hydroxy-4-methoxy-6-methylbenzoyloxy)-6-methylbenzoic acid
|
|
|
IUPAC Traditional name
|
2-hydroxy-4-(2-hydroxy-4-methoxy-6-methylbenzoyloxy)-6-methylbenzoic acid
|
|
|
Synonyms
|
Lecanoric acid methyl ether
|
2-Hydroxy-4-[2-hydroxy-4-methoxy-6-methylbenzoyloxy]-6-methylbenzoic acid
|
EVERNIC ACID
|
Evernic acid
|
|
|
CAS Number
|
|
EC Number
|
|
PubChem SID
|
|
PubChem CID
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
|
2.8407063
|
H Acceptors
|
6
|
H Donor
|
3
|
LogD (pH = 5.5)
|
2.2489705
|
LogD (pH = 7.4)
|
1.3615122
|
Log P
|
4.854305
|
Molar Refractivity
|
85.6245 cm3
|
Polarizability
|
32.166367 Å3
|
Polar Surface Area
|
113.29 Å2
|
Rotatable Bonds
|
5
|
Lipinski's Rule of Five
|
true
|
DETAILS
DETAILS
MP Biomedicals
REFERENCES
REFERENCES
From Suppliers
Google Scholar
PubMed
Google Books
- • Koller, G., Monatsh. Chem., 1932, 61, 147, (isol)
- • Yamazaki, M. et al., Chem. Pharm. Bull., 1965, 13, 1015, (biosynth)
- • Neelakantan, S. et al., Tetrahedron, 1965, 21, 3531, (synth)
- • Manaktala, S.K. et al., Tetrahedron, 1966, 22, 2373, (synth)
- • Huneck, S. et al., Tetrahedron, 1968, 24, 2707, (ms)
- • Huneck, S. et al., Z. Naturforsch., B, 1968, 23, 717, (pmr)
- • Elix, J.A. et al., Aust. J. Chem., 1988, 41, 1789, (synth)
- • Narui, T. et al., Phytochemistry, 1998, 48, 815-822, (pmr, cmr)
- • Rojas, I.S. et al., J. Nat. Prod., 2000, 63, 1396-1399, (activity)
- Searching...Please wait...
PATENTS
PATENTS
PubChem Patent
Google Patent