Structure Database (LMSD)
Common Name
Anziaic acid
Systematic Name
4-(2,4-dihydroxy-6-pentylbenzoyl)oxy-2-hydroxy-6-pentylbenzoic acid
Synonyms
3D model of Anziaic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
BEFYPHLCGVCBFF-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C24H30O7/c1-3-5-7-9-15-11-17(25)13-19(26)22(15)24(30)31-18-12-16(10-8-6-4-2)21(23(28)29)20(27)14-18/h11-14,25-27H,3-10H2,1-2H3,(H,28,29)
SMILES (Click to copy)
C1(O)C=C(CCCCC)C(C(OC2C=C(CCCCC)C(C(O)=O)=C(O)C=2)=O)=C(O)C=1
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Hypotrachyna sp.
(#2604699)
Lecanoromycetes
(#147547)
Identification of anziaic acid, a lichen depside from Hypotrachyna sp., as a new topoisomerase poison inhibitor.,
PLoS One, 2013
PLoS One, 2013
Pubmed ID:
23593306
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
31
Rings
2
Aromatic Rings
2
Rotatable Bonds
12
Van der Waals Molecular Volume
417.65
Topological Polar Surface Area
124.29
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
7
logP
5.19
Molar Refractivity
116.25
Admin
Created at
4th Feb 2022
Updated at
4th Feb 2022