Structure database (LMSD)

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LM IDLMFA07010036
Common NamePalmityl laurate
Systematic Namehexadecanyl dodecanoate
SynonymsWE(16:0/12:0); hexadecyl dodecanoate
Exact Mass
424.4280 (neutral)    Calculate m/z:
FormulaC28H56O2
CategoryFatty Acyls [FA]
Main ClassFatty esters [FA07]
Sub ClassWax monoesters [FA0701]
AbbrevWE 28:0
PubChem CID88709
CHEBI ID84080
SWISSLIPIDS IDSLM:000390001
InChIKeyVWOKINHIVGKNRX-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C28H56O2/c1-3-5-7-9-11-13-14-15-16-17-19-21-23-25-27-30-28(29)26-24-22-20-18-12-10-8-6-4-2/h3-27H2,1-2H3
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SMILES
O=C(CCCCCCCCCCC)OCCCCCCCCCCCCCCCC
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms30Rings0Aromatic Rings0Rotatable Bonds26
 van der Waals
Molecular Volume
507.90Topological Polar
Surface Area
26.30Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
2
 logP10.22Molar
Refractivity
133.61