Structure Database (LMSD)
Common Name
Lanoceric acid
Systematic Name
8,23-dihydroxytriacontanoic acid
Synonyms
LM ID
LMFA01050534
Formula
Exact Mass
Calculate m/z
484.44916
Sum Composition
Status
Active
3D model of Lanoceric acid
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
String Representations
InChiKey (Click to copy)
QGUHQIPBVVVKMJ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C30H60O4/c1-2-3-4-13-18-23-28(31)24-19-14-11-9-7-5-6-8-10-12-15-20-25-29(32)26-21-16-17-22-27-30(33)34/h28-29,31-32H,2-27H2,1H3,(H,33,34)
SMILES (Click to copy)
C(CCCCCCC(O)CCCCCCCCCCCCCCC(O)CCCCCCC)(=O)O
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
34
Rings
0
Aromatic Rings
0
Rotatable Bonds
28
Van der Waals Molecular Volume
560.08
Topological Polar Surface Area
77.76
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
4
logP
9.53
Molar Refractivity
146.39
Admin
Created at
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Updated at
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