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Home Other Building Blocks Olivetolic Acid

Olivetolic Acid

CAS No.:
491-72-5
Catalog Number:
AG00DZJ2
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
≥90% (mixture of isomers)
1 week
United States
$91
- +
25mg
≥90% (mixture of isomers)
1 week
United States
$161
- +
Product Description
Catalog Number:
AG00DZJ2
Chemical Name:
Olivetolic Acid
CAS Number:
491-72-5
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
MDL Number:
MFCD28383644
IUPAC Name:
2,4-dihydroxy-6-pentylbenzoic acid
InChI:
InChI=1S/C12H16O4/c1-2-3-4-5-8-6-9(13)7-10(14)11(8)12(15)16/h6-7,13-14H,2-5H2,1H3,(H,15,16)
InChI Key:
SXFKFRRXJUJGSS-UHFFFAOYSA-N
SMILES:
CCCCCc1cc(O)cc(c1C(=O)O)O
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.105g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
224.256g/mol
Monoisotopic Mass:
224.105g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
Identification of olivetolic acid cyclase from Cannabis sativa reveals a unique catalytic route to plant polyketides. Proceedings of the National Academy of Sciences of the United States of America 20120731
Activities of 2,4-dihydroxy-6-n-pentylbenzoic acid derivatives. Zeitschrift fur Naturforschung. C, Journal of biosciences 20080101
Structural basis for the promiscuous biosynthetic prenylation of aromatic natural products. Nature 20050616
6-alkylsalicylic acids and 6-alkylresorcylic acids from ants in the genus Crematogaster from Brunei. Journal of chemical ecology 20050201
Prenylation of olivetolate by a hemp transferase yields cannabigerolic acid, the precursor of tetrahydrocannabinol. FEBS letters 19980508
Properties