Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA13030003
Common Name3-O-α-L-rhamnopyranosyl-3-hydroxydecanoic acid
Systematic Name3-O-α-L-rhamnopyranosyl-3-hydroxydecanoic acid
Synonyms3-O-L-rhamnsyl-3-hydroxydecanoic acid
Exact Mass
334.1992 (neutral)    Calculate m/z:
FormulaC16H30O7
CategoryFatty Acyls [FA]
Main ClassFatty acyl glycosides [FA13]
Sub ClassRhamnolipids [FA1303]
PubChem CID56936287
InChIKeyULYNCQBACUVFJM-YWNUTFMVSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C16H30O7/c1-3-4-5-6-7-8-11(9-12(17)18)23-16-15(21)14(20)13(19)10(2)22-1
6/h10-11,13-16,19-21H,3-9H2,1-2H3,(H,17,18)/t10?,11?,13-,14?,15-,16?/m0/s1
SMILES[C@H]1(O)C(O)[C@@H](O)C(C)OC1OC(CCCCCCC)CC(=O)O
StatusActive
ReferencesAstonishing diversity of natural surfactants:
1. Glycosides of fatty acids and alcohols
Valery M. Dembitsky, LIPIDS
Volume 39, Number 10, 933-953 (2004)
Calculated physicochemical properties (?):
 Heavy Atoms23Rings1Aromatic Rings0Rotatable Bonds10
 van der Waals
Molecular Volume
331.89Topological Polar
Surface Area
118.52Hydrogen
Bond Donors
4Hydrogen
Bond Acceptors
7
 logP2.75Molar
Refractivity
85.93