Structure Database (LMSD)

Common Name
CerP(d18:1/22:0)
Systematic Name
N-(docosanoyl)-sphing-4-enine-1-phosphate
Synonyms
  • C22 CerP
LM ID
LMSP02050006
Formula
C40H80NO6P
Exact Mass
Calculate m/z
701.572327
Sum Composition
CerP 40:1;O2
Abbrev Chains
CerP 18:1;O2/22:0
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Sphingolipids [SP]
Ceramides [SP02]
Ceramide 1-phosphates [SP0205]

Reactions

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ⓘ Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
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Reactions graph legend

String Representations

InChiKey (Click to copy)
ZRTZYMMYLZPKEQ-GLQCRSEXSA-N
InChi (Click to copy)
InChI=1S/C40H80NO6P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(43)41-38(37-47-48(44,45)46)39(42)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h33,35,38-39,42H,3-32,34,36-37H2,1-2H3,(H,41,43)(H2,44,45,46)/b35-33+/t38-,39+/m0/s1
SMILES (Click to copy)
[C@](COP(=O)(O)O)([H])(NC(CCCCCCCCCCCCCCCCCCCCC)=O)[C@]([H])(O)/C=C/CCCCCCCCCCCCC

Other Databases

HMDB ID
HMDB0010703
CHEBI ID
73138
PubChem CID
5283585
SwissLipids ID
SLM:000395780

Calculated Physicochemical Properties

Heavy Atoms 48
Rings 0
Aromatic Rings 0
Rotatable Bonds 38
Van der Waals Molecular Volume 778.85
Topological Polar Surface Area 116.09
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 6
logP 13.22
Molar Refractivity 205.40

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Created at
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Updated at
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