Structure Database (LMSD)
Common Name
Glucosyl 25-hydroxyhexacosanoate
Systematic Name
α-D-glucopyranosyl 25-hydroxyhexacosanoate
Synonyms
3D model of Glucosyl 25-hydroxyhexacosanoate
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
Nodularia harveyana
(#114805)
Cyanophyceae
(#3028117)
Structure of the “heterocyst glycolipids” of the marine cyanobacterium Nodularia harveyana,
Tetrahedron, 1992
Tetrahedron, 1992
String Representations
InChiKey (Click to copy)
ATMCRTHCTLYXPM-CTGWYOPZSA-N
InChi (Click to copy)
InChI=1S/C32H62O8/c1-26(34)23-21-19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20-22-24-28(35)40-32-31(38)30(37)29(36)27(25-33)39-32/h26-27,29-34,36-38H,2-25H2,1H3/t26?,27-,29-,30+,31-,32-/m1/s1
SMILES (Click to copy)
O([C@@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C(=O)CCCCCCCCCCCCCCCCCCCCCCCC(O)C
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
40
Rings
1
Aromatic Rings
0
Rotatable Bonds
27
Van der Waals Molecular Volume
617.48
Topological Polar Surface Area
138.75
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
8
logP
7.69
Molar Refractivity
161.29
Admin
Created at
-
Updated at
24th Mar 2021