Structure Database (LMSD)

Common Name
Nor-Dolichoic acid-[13-22]
Systematic Name
Synonyms
LM ID
LMPR03070024
Status
Active
Exact Mass
Calculate m/z
360.30283
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)
XKOAXHKWXLCOGH-YQUIFEAJSA-N
InChi (Click to copy)
InChI=1S/C24H40O2/c1-19(2)11-7-12-20(3)13-8-14-21(4)15-9-16-22(5)17-10-18-23(6)24(25)26/h11,13,15,17,23H,7-10,12,14,16,18H2,1-6H3,(H,25,26)/b20-13+,21-15+,22-17-/t23-/m0/s1
SMILES (Click to copy)
C([C@H](C)C(=O)O)C{-}/C=C(\C{+n}C/C=C(/CC/C=C(\C)/CC/C=C(\C)/C)\C)/C

References

Other Databases

PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 26
Rings 0
Aromatic Rings 0
Rotatable Bonds 13
Van der Waals Molecular Volume 428.14
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 7.63
Molar Refractivity 114.44

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Created at
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Updated at
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