Structure Database (LMSD)
Common Name
Eudoraenol
Systematic Name
Synonyms
3D model of Eudoraenol
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
References
String Representations
InChiKey (Click to copy)
HHVVWYASWLBJFS-HJRZGONWSA-N
InChi (Click to copy)
InChI=1S/C29H48O/c1-18(2)19-8-9-20-21-10-11-23-22(28(21,6)17-16-27(19,20)5)12-13-24-26(3,4)25(30)14-15-29(23,24)7/h10,18-20,22-25,30H,8-9,11-17H2,1-7H3/t19-,20+,22-,23+,24-,25-,27-,28+,29+/m0/s1
SMILES (Click to copy)
C1C[C@]2(C)[C@]3([H])CC=C4[C@@]5([H])CC[C@@H](C(C)C)[C@]5(C)CC[C@@]4(C)[C@@]3([H])CC[C@@]2([H])C(C)(C)[C@H]1O
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
30
Rings
5
Aromatic Rings
Rotatable Bonds
1
Van der Waals Molecular Volume
454.61
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
7.92
Molar Refractivity
126.54
Admin
Created at
27th Mar 2023
Updated at
27th Apr 2023