LIPID MAPS

Structure Database (LMSD)

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Common Name

M(IP)2C(t18:0/18:0)

Systematic Name

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

Synonyms

LM ID

LMSP03030109

Formula

C₅₄H₁₀₅NO₂₅P₂

Exact Mass

Calculate m/z

1229.6451

Sum Composition

M(IP)2C 36:0;O3

Abbrev Chains

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

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)

UIDMOZNMSGWCRI-HIVBIFFWSA-N

InChi (Click to copy)

InChI=1S/C54H105NO25P2/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-37(57)55-34(38(58)35(56)30-28-26-24-22-20-16-14-12-10-8-6-4-2)32-75-81(71,72)80-53-49(69)45(65)44(64)48(68)52(53)78-54-50(70)40(60)39(59)36(77-54)33-76-82(73,74)79-51-46(66)42(62)41(61)43(63)47(51)67/h34-36,38-54,56,58-70H,3-33H2,1-2H3,(H,55,57)(H,71,72)(H,73,74)/t34-,35+,36+,38-,39+,40-,41-,42-,43+,44-,45-,46+,47+,48+,49+,50-,51-,52+,53-,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)CCCCCCCCCCCCCCCCC)[C@]([H])(O)[C@H](O)CCCCCCCCCCCCCC