Structure Database (LMSD)

Common Name
Dolichoic acid-[18-20]
Systematic Name
Synonyms
LM ID
LMPR03070025
Formula
C25H42O2
Exact Mass
Calculate m/z
374.31848
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Prenol Lipids [PR]
Polyprenols [PR03]
Dolichols [PR0307]

String Representations

InChiKey (Click to copy)
ODMPTSNPVHBMBA-ZTWRLTPTSA-N
InChi (Click to copy)
InChI=1S/C25H42O2/c1-20(2)11-7-12-21(3)13-8-14-22(4)15-9-16-23(5)17-10-18-24(6)19-25(26)27/h11,13,15,17,24H,7-10,12,14,16,18-19H2,1-6H3,(H,26,27)/b21-13+,22-15+,23-17-/t24-/m0/s1
SMILES (Click to copy)
C([C@H](C)CC(O)=O)C{-}/C=C(\C{+n}C/C=C(/CC/C=C(\C)/CC/C=C(\C)/C)\C)/C

Other Databases

PubChem CID
24779570

Calculated Physicochemical Properties

Heavy Atoms 27
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 445.44
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 8.02
Molar Refractivity 119.05

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Updated at
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