LIPID MAPS

Structure Database (LMSD)

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Common Name

M(IP)2C(d20:0/20:0)

Systematic Name

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

Synonyms

LM ID

LMSP03030134

Formula

C₅₈H₁₁₃NO₂₄P₂

Exact Mass

Calculate m/z

1269.712782

Sum Composition

M(IP)2C 40:0;O2

Abbrev Chains

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

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

DOI: 10.1002/yea.1362

String Representations

InChiKey (Click to copy)

ULVWYFLSBMGPBT-CMEQZQADSA-N

InChi (Click to copy)

InChI=1S/C58H113NO24P2/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-42(61)59-39(40(60)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2)37-78-84(74,75)83-57-53(72)49(68)48(67)52(71)56(57)81-58-54(73)44(63)43(62)41(80-58)38-79-85(76,77)82-55-50(69)46(65)45(64)47(66)51(55)70/h39-41,43-58,60,62-73H,3-38H2,1-2H3,(H,59,61)(H,74,75)(H,76,77)/t39-,40+,41+,43+,44-,45-,46-,47+,48-,49-,50+,51+,52+,53+,54-,55-,56+,57-,58+/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)CCCCCCCCCCCCCCCCCCC)[C@]([H])(O)CCCCCCCCCCCCCCCCC