LIPID MAPS

Structure Database (LMSD)

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Common Name

M(IP)2C(t18:0/16:0(2OH))

Systematic Name

N-(2-hydroxyhexadecanoyl)-4R-hydroxysphinganine-1-O-[myo-inositol-1-phosphoryl-6-D-mannopyranosyl-α1-2-myo-inositol-1-phosphate]

Synonyms

N-(2-hydroxyhexadecanoyl)-4R-hydroxysphinganine-1-phospho-1'-[2'-O-alpha-D-mannopyranosyl-myo-inositol]

LM ID

LMSP03030102

Formula

C₅₂H₁₀₁NO₂₆P₂

Exact Mass

Calculate m/z

1217.608712

Sum Composition

M(IP)2C 34:0;O4

Abbrev Chains

M(IP)2C 18:0;O3/16:0;O

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)

YKFKQJKCOZIQIG-GFGHYJCLSA-N

InChi (Click to copy)

InChI=1S/C52H101NO26P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32(54)35(56)31(53-51(69)33(55)28-26-24-22-20-18-16-14-12-10-8-6-4-2)29-74-80(70,71)79-50-46(67)42(63)41(62)45(66)49(50)77-52-47(68)37(58)36(57)34(76-52)30-75-81(72,73)78-48-43(64)39(60)38(59)40(61)44(48)65/h31-50,52,54-68H,3-30H2,1-2H3,(H,53,69)(H,70,71)(H,72,73)/t31-,32+,33?,34+,35-,36+,37-,38-,39-,40+,41-,42-,43+,44+,45+,46+,47-,48-,49+,50-,52+/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)C(O)CCCCCCCCCCCCCC)[C@]([H])(O)[C@H](O)CCCCCCCCCCCCCC