Structure Database (LMSD)
Common Name
Furodysin
Systematic Name
Synonyms
3D model of Furodysin
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
Dysidea cf. pallescens DE-2012
(#1163354)
Demospongiae
(#6042)
Two sesquiterpene furans with new carbocyclic ring systems and related thiol acetates from a species of the sponge genus dysidea,
Tetrahedron Letts, 1978
Tetrahedron Letts, 1978
String Representations
InChiKey (Click to copy)
DIPYJSWOBDKTRL-CHWSQXEVSA-N
InChi (Click to copy)
InChI=1S/C15H20O/c1-10-4-5-13-12(8-10)9-11-6-7-16-14(11)15(13,2)3/h6-8,12-13H,4-5,9H2,1-3H3/t12-,13-/m1/s1
SMILES (Click to copy)
C1(C)=C[C@]2([H])CC3C=COC=3C(C)(C)[C@]2([H])CC1
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
16
Rings
3
Aromatic Rings
1
Rotatable Bonds
0
Van der Waals Molecular Volume
220.95
Topological Polar Surface Area
13.14
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
4.09
Molar Refractivity
65.41
Admin
Created at
-
Updated at
4th May 2021