LIPID MAPS

Structure Database (LMSD)

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Common Name

M(IP)2C(d20:0/18:0)

Systematic Name

N-(octadecanoyl)-eicosasphinganine-1-O-[myo-inositol-1-phosphoryl-6-D-mannopyranosyl-α1-2-myo-inositol-1-phosphate]

Synonyms

LM ID

LMSP03030133

Formula

C₅₆H₁₀₉NO₂₄P₂

Exact Mass

Calculate m/z

1241.681485

Sum Composition

M(IP)2C 38:0;O2

Abbrev Chains

M(IP)2C 20:0;O2/18:0

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

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)

BUNREBAZWUFDID-CIRGNBINSA-N

InChi (Click to copy)

InChI=1S/C56H109NO24P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(58)37(57-40(59)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)35-76-82(72,73)81-55-51(70)47(66)46(65)50(69)54(55)79-56-52(71)42(61)41(60)39(78-56)36-77-83(74,75)80-53-48(67)44(63)43(62)45(64)49(53)68/h37-39,41-56,58,60-71H,3-36H2,1-2H3,(H,57,59)(H,72,73)(H,74,75)/t37-,38+,39+,41+,42-,43-,44-,45+,46-,47-,48+,49+,50+,51+,52-,53-,54+,55-,56+/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](COP(O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)(=O)O)O1)([H])(NC(=O)CCCCCCCCCCCCCCCCC)[C@]([H])(O)CCCCCCCCCCCCCCCCC