Structure Database (LMSD)
Common Name
Folipastatin
Systematic Name
Synonyms
3D model of Folipastatin
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Aspergillus unguis
(#40381)
Eurotiomycetes
(#147545)
Folipastatin, a new depsidone compound from Aspergillus unguis as an inhibitor of phospholipase A2. Taxonomy, fermentation, isolation, structure determination and biological properties.,
J Antibiot (Tokyo), 1992
J Antibiot (Tokyo), 1992
Pubmed ID:
1399838
String Representations
InChiKey (Click to copy)
JJMKBGPTPXPMBH-MKICQXMISA-N
InChi (Click to copy)
InChI=1S/C23H24O5/c1-7-11(3)15-9-17(24)13(5)20-19(15)23(26)28-21-14(6)18(25)10-16(12(4)8-2)22(21)27-20/h7-10,24-25H,1-6H3/b11-7+,12-8+
SMILES (Click to copy)
C1(/C(/C)=C/C)=CC(O)=C(C)C2OC3=C(/C(/C)=C/C)C=C(O)C(C)=C3OC(=O)C1=2
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
28
Rings
3
Aromatic Rings
2
Rotatable Bonds
2
Van der Waals Molecular Volume
367.77
Topological Polar Surface Area
80.13
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
logP
5.89
Molar Refractivity
109.37
Admin
Created at
4th Feb 2022
Updated at
4th Feb 2022