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
Main
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
References
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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