LIPID MAPS

Structure Database (LMSD)

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Common Name

MIPC(t18:0/18:0(2OH))

Systematic Name

N-(2-hydroxyoctadecanoyl)-4R-hydroxysphinganine-1-O-[D-mannopyranosyl-α1-2-myo-inositol-1-phosphate]

Synonyms

LM ID

LMSP03030073

Formula

C₄₈H₉₄NO₁₈P

Exact Mass

Calculate m/z

1003.620857

Sum Composition

MIPC 36:0;O4

Abbrev Chains

MIPC 18:0;O3/18:0;O

Status

Active

Show lipids differing only in stereochemistry/bond geometry

No other lipid differing only in stereochemistry/bond geometry found

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Saccharomyces cerevisiae (#4932)

Saccharomycetes (#4891)

Mass spectrometry-based profiling of phospholipids and sphingolipids in extracts from Saccharomyces cerevisiae.,
Yeast, 2006

Pubmed ID: 16652392

String Representations

InChiKey (Click to copy)

PFQMCDBSNNEVRV-DJJVFJBZSA-N

InChi (Click to copy)

InChI=1S/C48H94NO18P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-35(52)47(61)49-33(37(53)34(51)29-27-25-23-21-19-16-14-12-10-8-6-4-2)32-64-68(62,63)67-46-43(59)41(57)40(56)42(58)45(46)66-48-44(60)39(55)38(54)36(31-50)65-48/h33-46,48,50-60H,3-32H2,1-2H3,(H,49,61)(H,62,63)/t33-,34+,35?,36+,37-,38+,39-,40-,41-,42+,43+,44-,45+,46-,48+/m0/s1

SMILES (Click to copy)

[C@](COP(=O)(O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@@H]1[C@@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)([H])(NC(=O)C(O)CCCCCCCCCCCCCCCC)[C@]([H])(O)[C@H](O)CCCCCCCCCCCCCC