Structure Database (LMSD)

Common Name
17-trimethylarsenylheptadecan-1-ol
Systematic Name
17-trimethylarsenylheptadecan-1-ol
Synonyms
LM ID
LMFA00000043
Status
Active
Exact Mass
Calculate m/z
375.260811
Formula


Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
ITQUSLJANGKIFT-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C20H44AsO/c1-21(2,3)19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22/h22H,4-20H2,1-3H3/q+1
SMILES (Click to copy)
C(CCO)CCCCCCCCCCCCCC[As+](C)(C)C

References

Reference
Fat-soluble arsenic - new lipids with a sting in their tail
Lipid Technology Kevin A. Francesconi,Tanja Schwerdtle, Vol.28(5-6), pp96-98, 2016
https://doi.org/10.1002/lite.201600024

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Saccharina latissima (#309358)
Phaeophyceae (#2870)
Fat-soluble arsenic - new lipids with a sting in their tail,
Lipid Tech, 2016

Other Databases

PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 22
Rings 0
Aromatic Rings 0
Rotatable Bonds 17
Van der Waals Molecular Volume 386.59
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 7.45
Molar Refractivity 104.98

Admin

Created at
4th Oct 2019
Updated at
27th May 2021