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LM ID | LMFA01030084 |
Common Name | cis-Gadoleic acid |
Systematic Name | 9Z-eicosenoic acid |
Synonyms | cis-9-eicosenoic acid; cis-9-icosenoic acid; C20:1n-11; Gadoleic acid; Gondoleic acid; 9Z-eicosenic acid |
Exact Mass | |
Formula | C20H38O2 |
Category | Fatty Acyls [FA] |
Main Class | Fatty Acids and Conjugates [FA01] |
Sub Class | Unsaturated fatty acids [FA0103] |
LIPIDBANK ID | DFA0123 |
PubChem CID | 5282767 |
HMDB ID | HMDB0062436 |
CHEBI ID | 32419 |
PlantFA ID | 10129 |
InChIKey | LQJBNNIYVWPHFW-QXMHVHEDSA-N
Show lipids differing only in stereochemistry/bond geometry |
InChI | InChI=1S/C20H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h11- 12H,2-10,13-19H2,1H3,(H,21,22)/b12-11- |
SMILES | C(CCCCCCC(=O)O)/C=C\CCCCCCCCCC |
MS Spectra | - |
Status | Active |
Calculated physicochemical properties (?): |
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| Heavy Atoms | 22 | Rings | 0 | Aromatic Rings | 0 | Rotatable Bonds | 17 |
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| van der Waals Molecular Volume | 366.86 | Topological Polar Surface Area | 37.30 | Hydrogen Bond Donors | 1 | Hydrogen Bond Acceptors | 2 |
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| logP | 6.89 | Molar Refractivity | 96.32 | | | | |
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