C-8 Ceramide-1-phosphate

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Systematic / IUPAC Name: (2S,3R,4E)-3-Hydroxy-2-(octanoylamino)-4-octadecen-1-yl dihydrogen phosphate

ID: Reference4429

Other Names: N-Octanoylsphing-4-enine 1-phosphate;
N-Octanoylsphingosine-1-phosphate;
CerP(d18:1/8:0);
(2S,3R,4E)-3-Hydroxy-2-(octanoylamino)octadec-4-En-1-yl dihydrogen phosphate

Formula: C26H52NO6P

Class: Endogenous Metabolites

Spectral Data

C-8 Ceramide-1-phosphate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 1781
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers IT; FT
Last Modification 4/6/2016 8:43:38 AM
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Identificators

InChI InChI=1S/C26H52NO6P/c1-3-5-7-9-10-11-12-13-14-15-16-18-19-21-25(28)24(23-33-34(30,31)32)27-26(29)22-20-17-8-6-4-2/h19,21,24-25,28H,3-18,20,22-23H2,1-2H3,(H,27,29)(H2,30,31,32)/b21-19+/t24-,25+/m0/s1
InChI Key VSSNYUXSRXINIP-WRBRXSDHSA-N
Canonical SMILES CCCCCCCCCCCCCC=CC(C(COP(=O)(O)O)NC(=O)CCCCCCC)O
CAS 158983530
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Other Names N-Octanoylsphing-4-enine 1-phosphate;
N-Octanoylsphingosine-1-phosphate;
CerP(d18:1/8:0);
(2S,3R,4E)-3-Hydroxy-2-(octanoylamino)octadec-4-En-1-yl dihydrogen phosphate

In Other Databases

ChEBI CHEBI:85881
PubChem 10864091
ChemSpider 9039378