Structure Database (LMSD)

Common Name
6-Tuliposide A
Systematic Name
6-O-(4-hydroxy-2-methylene-butanoyl)-β-D-glucopyranose
Synonyms
LM ID
LMSL05000002
Formula
C11H18O8
Exact Mass
Calculate m/z
278.10017
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Saccharolipids [SL]
Other acyl sugars [SL05]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Persoonia linearis (#488382)
Magnoliopsida (#3398)
Astonishing diversity of natural surfactants: 1. Glycosides of fatty acids and alcohols.,
Lipids, 2004
Pubmed ID: 15691016

String Representations

InChiKey (Click to copy)
NABVFHUVYXEKSQ-ZBGLXGBJSA-N
InChi (Click to copy)
InChI=1S/C11H18O8/c1-5(2-3-12)10(16)18-4-6-7(13)8(14)9(15)11(17)19-6/h6-9,11-15,17H,1-4H2/t6-,7-,8+,9-,11-/m1/s1
SMILES (Click to copy)
O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(C(=C)CCO)=O)O1

Other Databases

PubChem CID
21119819

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 1
Aromatic Rings 0
Rotatable Bonds 6
Van der Waals Molecular Volume 251.54
Topological Polar Surface Area 138.75
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 8
logP -0.73
Molar Refractivity 64.24

Admin

Created at
-
Updated at
12th May 2020