Structure Database (LMSD)
Common Name
3-Gymnomitrene
Systematic Name
Synonyms
3D model of 3-Gymnomitrene
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
Level 4 Class
String Representations
InChiKey (Click to copy)
RMKQBFUAKZOVPQ-KBXIAJHMSA-N
InChi (Click to copy)
InChI=1S/C15H24/c1-11-6-9-13(2)10-12(11)14(3)7-5-8-15(13,14)4/h6,12H,5,7-10H2,1-4H3/t12-,13-,14+,15+/m1/s1
SMILES (Click to copy)
C1C=C(C)[C@@H]2[C@]3(C)CCC[C@@]3(C)[C@@]1(C)C2
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
3
Aromatic Rings
0
Rotatable Bonds
0
Van der Waals Molecular Volume
228.34
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
4.56
Molar Refractivity
64.65
Admin
Created at
-
Updated at
-