LIPID MAPS

Structure Database (LMSD)

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Common Name

Galalpha-Cer(d16:0(15Me)/16:0(3OH[R])(15Me)

Systematic Name

N-(15-methylhexdecanoyl)-1-α-D-galactosyl-15-methylhexadecasphinganine

Synonyms

LM ID

LMSP05010213

Formula

C₄₀H₇₉NO₉

Exact Mass

Calculate m/z

717.575485

Sum Composition

HexCer 34:0;O3

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Comments

Submitted by B Spenceley & D Campopiano

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Bacteroides fragilis (#817)

Bacteroidia (#200643)

Production of α-galactosylceramide by a prominent member of the human gut microbiota.,
PLoS Biol, 2013

Pubmed ID: 23874157

DOI: 10.1371/journal.pbio.1001610

String Representations

InChiKey (Click to copy)

TVSWUEMHNUKUAZ-OGMOURDSSA-N

InChi (Click to copy)

InChI=1S/C40H79NO9/c1-30(2)23-19-15-11-7-5-9-13-17-21-25-32(43)27-36(45)41-33(29-49-40-39(48)38(47)37(46)35(28-42)50-40)34(44)26-22-18-14-10-6-8-12-16-20-24-31(3)4/h30-35,37-40,42-44,46-48H,5-29H2,1-4H3,(H,41,45)/t32-,33+,34-,35-,37+,38+,39-,40+/m1/s1

SMILES (Click to copy)

[C@](CO[C@@H]1[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O1)([H])(NC(C[C@H](O)CCCCCCCCCCCC(C)C)=O)[C@]([H])(O)CCCCCCCCCCCC(C)C