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N-[(1R,2S)-2-Hydroxy-1-hydroxymethyl-2-(2-tridecyl-1-cyclopropenyl)ethyl]octanamide
Catalog NumberACM649767839
CAS Number649767-83-9
CategoryBioactive Lipids
Synonyms
GT-11 Dihydroceramide desaturase inhibitor
IUPAC Name
N-[(1S,2R)-1,3-dihydroxy-1-(2-tridecylcyclopropen-1-yl)propan-2-yl]octanamide
Molecular Weight
451.73
Molecular Formula
C28H53NO3
SMILES
CCCCCCCCCCCCCC1=C(C1)[C@@H]([C@@H](CO)NC(=O)CCCCCCC)O
InChI
WHXCOSOMEQMKRN-VPUSJEBWSA-N
InChI Key
InChI=1S/C27H51NO3/c1-3-5-7-9-10-11-12-13-14-16-17-19-23-21-24(23)27(31)25(22-29)28-26(30)20-18-15-8-6-4-2/h25,27,29,31H,3-22H2,1-2H3,(H,28,30)/t25-,27+/m1/s1
Boiling Point
613.1±55.0 °C(Predicted)
Purity
>99%
Density
0.978±0.06 g/cm3(Predicted)
Appearance
Powder
Exact Mass
451.403
Hygroscopic
No
Light Sensitive
No
Percent Composition
C 74.45%, H 11.83%, N 3.10%, O 10.63%
pKa
13.96±0.20(Predicted)
Stability
1 Years
Storage Temperature
-20 °C
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