Structure Database (LMSD)
Common Name
Adipostatin J
Systematic Name
5-eiscosylbenzene-1,3-diol
Synonyms
- 5-n-eicosylresorcinol
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
JCDQIGVVGKBORW-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C26H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-21-25(27)23-26(28)22-24/h21-23,27-28H,2-20H2,1H3
SMILES (Click to copy)
C1(O)C=C(CCCCCCCCCCCCCCCCCCCC)C=C(O)C=1
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Streptomyces sp. 20733-1
(#1774111)
Actinomycetia
(#1760)
Adipostatins E-J, New Potent Antimicrobials Identified as Inhibitors of Coenzyme-A Biosynthesis.,
Tetrahedron Letts, 2020
Tetrahedron Letts, 2020
Pubmed ID:
32863451
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
28
Rings
1
Aromatic Rings
1
Rotatable Bonds
19
Van der Waals Molecular Volume
444.76
Topological Polar Surface Area
40.46
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
logP
8.68
Molar Refractivity
122.26
Admin
Created at
28th Oct 2020
Updated at
28th Oct 2020