Structure Database (LMSD)
Common Name
Thapsic acid
Systematic Name
Hexadecanedioic acid
Synonyms
- Thaspic acid
LM ID
LMFA01170022
Status
Active
Exact Mass
Calculate m/z
286.21441
Formula
Abbrev
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
QQHJDPROMQRDLA-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H30O4/c17-15(18)13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(19)20/h1-14H2,(H,17,18)(H,19,20)
SMILES (Click to copy)
C(CCCCCCCCCCCCCCC(=O)O)(=O)O
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Homo sapiens
(#9606)
Mammalia
(#40674)
Subcellular localization of hexadecanedioic acid activation in human liver.,
J Lipid Res, 1974
J Lipid Res, 1974
Pubmed ID:
4372285
Thapsia garganica
(#79022)
Magnoliopsida
(#3398)
“Thapsic acid.” Merriam-Webster.com Dictionary, Merriam-Webster, https://www.merriam-webster.com/dictionary/thapsic%20acid. Accessed 8 Feb. 2021.
Other Databases
LIPIDAT ID
1814
KEGG ID
HMDB ID
CHEBI ID
PubChem CID
PlantFA ID
SwissLipids ID
Calculated Physicochemical Properties
Heavy Atoms
20
Rings
0
Aromatic Rings
0
Rotatable Bonds
15
Van der Waals Molecular Volume
315.24
Topological Polar Surface Area
74.60
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
logP
4.62
Molar Refractivity
79.91
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