LIPID MAPS

Structure Database (LMSD)

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Common Name

GalAalphaCer(d21:1(13cy3)/14:0(2OH))

Systematic Name

N-(2-hydroxytetradecanoyl)-1-α-galacturonosyl-13,14-methylene-eicosasphinganine

Synonyms

LM ID

LMSP06000004

Formula

C₄₁H₇₇NO₁₀

Exact Mass

Calculate m/z

743.55475

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

Rhizorhabdus wittichii RW1 (#392499)

Alphaproteobacteria (#28211)

Occurrence of an alpha-galacturonosyl-ceramide in the dioxin-degrading bacterium Sphingomonas wittichii.,
FEMS Microbiol Lett, 2002

Pubmed ID: 12351245

DOI: 10.1111/j.1574-6968.2002.tb11361.x

String Representations

InChiKey (Click to copy)

QLOMAZHROXJKKU-CKVSEYLESA-N

InChi (Click to copy)

InChI=1S/C41H77NO10/c1-3-5-7-9-10-11-12-15-19-23-27-34(44)39(48)42-32(29-51-41-37(47)35(45)36(46)38(52-41)40(49)50)33(43)26-22-18-16-13-14-17-21-25-31-28-30(31)24-20-8-6-4-2/h30-38,41,43-47H,3-29H2,1-2H3,(H,42,48)(H,49,50)/t30?,31?,32-,33+,34?,35-,36+,37+,38-,41-/m0/s1

SMILES (Click to copy)

O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C(=O)O)O[C@@H]1OC[C@]([H])(NC(C(O)CCCCCCCCCCCC)=O)[C@]([H])(O)CCCCCCCCCC1CC1CCCCCC