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hexacosanoic acid - Substance Summary (SID 7849679)

a C(26) saturated acid


Drug and Chemical Information: (Total:1)         

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Data Source:   
Depositor: LipidMAPS
External ID: LMFA01010026

Depositor-Supplied Synonyms: (Total: 3)
Sort:
Cerotic acid
HEXACOSANOIC ACID
LMFA01010026


Properties Computed from Structure:
Molecular Weight396.68988 [g/mol]
Molecular FormulaC26H52O2
XLogP311.8
H-Bond Donor1
H-Bond Acceptor2
Rotatable Bond Count24
Exact Mass396.396731
MonoIsotopic Mass396.396731
Topological Polar Surface Area37.3
Heavy Atom Count28
Formal Charge0
Complexity301
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1


Descriptors Computed from Structure:
IUPAC Name: hexacosanoic acid
Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
InChI: InChI=1S/C26H52O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-
21-22-23-24-25-26(27)28/h2-25H2,1H3,(H,27,28)
InChIKey: XMHIUKTWLZUKEX-UHFFFAOYSA-N


Substance Information:
SID 7849679   
Deposit Date: 2006-01-13
Modify Date: 2008-05-14

CID 10469   
Create Date: 2004-09-16

Related Substances:
Same: 21 Links

Similar Substances: 2676 Links

     
Compound Displayed

2D

3D
Compound ID10469
Molecular Weight396.68988 [g/mol]
Molecular FormulaC26H52O2
XLogP311.8
H-Bond Donor1
H-Bond Acceptor2


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