LIPID MAPS

Structure Database (LMSD)

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Common Name

GlcCer(d20:3(4E,8E,10E)(9Me)/16:1(3E)(2OH[R]))

Systematic Name

N-(2R-hydroxy-3E-hexadecenoyl)-1-β-D-glucosyl-9-methyl-eicosasphinga-4E,8E,10E-trienine

Synonyms

LM ID

LMSP05010208

Formula

C₄₃H₇₇NO₉

Exact Mass

Calculate m/z

751.559835

Sum Composition

HexCer 37:4;O3

Abbrev Chains

GlcCer 21:3;O2/16:1;O

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

Sorangium cellulosum So ce56 (#448385)

Unusual outer membrane lipid composition of the gram-negative, lipopolysaccharide-lacking myxobacterium Sorangium cellulosum So ce56.,
J Biol Chem, 2011

Pubmed ID: 21321121

DOI: 10.1074/jbc.m110.194209

String Representations

InChiKey (Click to copy)

RCPQPSQGLKFBFS-UTQGHPBTSA-N

InChi (Click to copy)

InChI=1S/C43H77NO9/c1-4-6-8-10-12-14-15-16-18-20-22-26-31-37(47)42(51)44-35(33-52-43-41(50)40(49)39(48)38(32-45)53-43)36(46)30-27-23-25-29-34(3)28-24-21-19-17-13-11-9-7-5-2/h24,26-31,35-41,43,45-50H,4-23,25,32-33H2,1-3H3,(H,44,51)/b28-24+,30-27+,31-26+,34-29+/t35-,36+,37+,38+,39+,40-,41+,43+/m0/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@H](O)/C=C/CCCCCCCCCCCC)=O)[C@]([H])(O)/C=C/CC/C=C(\C)/C=C/CCCCCCCCC