N-C12-desoxymethylsphingosine

Catalog NumberBL-M001071
CAS Number1246298-55-4
DescriptionN-C12-desoxymethylsphingosine is a synthetic analogue of sphingosine used as a modulator of ceramide biosynthesis. It has potential antineoplastic activity against various cancers, including leukemia, due to its ability to induce cell cycle arrest and trigger apoptotic cell death.
IUPAC NameN-[(E,2R)-2-hydroxyheptadec-3-enyl]dodecanamide
SynonymsN-lauroyl-1-desoxymethylsphingosine (m17:1/12:0); Dodecanamide, N-[(2R,3E)-2-hydroxy-3-heptadecen-1-yl]-; N-dodecanoyl-1-desoxymethylsphing-3-enine (m17:1/12:0); N-C12-1-desoxy; MeCer
Molecular Weight451.77
Molecular FormulaC29H57NO2
Boiling Point589.8±43.0 °C at 760 mmHg
Purity>99%
Density0.9±0.1 g/cm3
AppearancePowder
Shelf Life1 Year
StorageStore at -20°C
Percent CompositionC 77.10%, H 12.72%, N 3.10%, O 7.08%
Canonical SMILESCCCCCCCCCCCCCC=CC(CNC(=O)CCCCCCCCCCC)O
InChIInChI=1S/C29H57NO2/c1-3-5-7-9-11-13-14-15-16-18-19-21-23-25-28(31)27-30-29(32)26-24-22-20-17-12-10-8-6-4-2/h23,25,28,31H,3-22,24,26-27H2,1-2H3,(H,30,32)/b25-23+/t28-/m1/s1
InChI KeyNQTIAYDGVUCKFJ-KSPVXFDASA-N

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