LIPID MAPS

Structure Database (LMSD)

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Common Name

M(IP)2C(t20:0/16:0(2OH))

Systematic Name

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

Synonyms

LM ID

LMSP03030138

Formula

C₅₄H₁₀₅NO₂₆P₂

Exact Mass

Calculate m/z

1245.640015

Sum Composition

M(IP)2C 36:0;O4

Abbrev Chains

M(IP)2C 20:0;O3/16:0;O

Status

Active

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)

FZRALJNCVYAPSX-XWPAFJMKSA-N

InChi (Click to copy)

InChI=1S/C54H105NO26P2/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-34(56)37(58)33(55-53(71)35(57)30-28-26-24-22-19-16-14-12-10-8-6-4-2)31-76-82(72,73)81-52-48(69)44(65)43(64)47(68)51(52)79-54-49(70)39(60)38(59)36(78-54)32-77-83(74,75)80-50-45(66)41(62)40(61)42(63)46(50)67/h33-52,54,56-70H,3-32H2,1-2H3,(H,55,71)(H,72,73)(H,74,75)/t33-,34+,35?,36+,37-,38+,39-,40-,41-,42+,43-,44-,45+,46+,47+,48+,49-,50-,51+,52-,54+/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)CCCCCCCCCCCCCCCC