Structure Database (LMSD)
Common Name
Glutinol
Systematic Name
Synonyms
- epi-Alnusenol
- glutin-5-en-3beta-ol
3D model of Glutinol
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
Level 4 Class
String Representations
InChiKey (Click to copy)
HFSACQSILLSUII-YEPLBTPASA-N
InChi (Click to copy)
InChI=1S/C30H50O/c1-25(2)13-14-27(5)15-17-29(7)22-11-9-20-21(10-12-24(31)26(20,3)4)28(22,6)16-18-30(29,8)23(27)19-25/h9,21-24,31H,10-19H2,1-8H3/t21?,22?,23?,24-,27+,28-,29+,30-/m0/s1
SMILES (Click to copy)
CC1(C)CC2[C@@](C)(CC[C@@]3(C)[C@@]2(C)CC[C@]2(C)C3CC=C3C(C)(C)[C@@H](O)CCC32)CC1
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Garcinia kola
(#469930)
Magnoliopsida
(#3398)
Garcinoic Acids and a Benzophenone Derivative from the Seeds of Garcinia kola and Their Antibacterial Activities against Oral Bacterial Pathogenic Organisms.,
J Nat Prod, 2020
J Nat Prod, 2020
Pubmed ID:
32644811
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
31
Rings
5
Aromatic Rings
0
Rotatable Bonds
0
Van der Waals Molecular Volume
471.91
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
8.46
Molar Refractivity
131.23
Admin
Created at
10th Jul 2020
Updated at
10th Jul 2020