LIPID MAPS

Structure Database (LMSD)

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Common Name

GlcCer(d18:3(4E,8E,10E)(9Me)/16:0)

Systematic Name

N-(hexadecanoyl)-1-α-glucosyl-9-methyl-4E,8E,10E-sphingatrienine

Synonyms

Thraustochytroside A

LM ID

LMSP05010091

Formula

C₄₁H₇₅NO₈

Exact Mass

Calculate m/z

709.549269

Sum Composition

HexCer 35:3;O2

Abbrev Chains

GlcCer 19:3;O2/16:0

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Monorhizochytrium globosum (#1884240)

Bigyra (#2683628)

Thraustochytrosides A-C: new glycosphingolipids from a unique marine protist, Thraustochytrium globosum,
Tetrahedron Letts, 1999

DOI: 10.1016/S0040-4039(99)01562-2

String Representations

InChiKey (Click to copy)

PIJBDQIAXDOOIW-VLDVQXRISA-N

InChi (Click to copy)

InChI=1S/C41H75NO8/c1-4-6-8-10-12-13-14-15-16-17-19-21-26-30-37(45)42-34(32-49-41-40(48)39(47)38(46)36(31-43)50-41)35(44)29-25-22-24-28-33(3)27-23-20-18-11-9-7-5-2/h23,25,27-29,34-36,38-41,43-44,46-48H,4-22,24,26,30-32H2,1-3H3,(H,42,45)/b27-23+,29-25+,33-28+/t34-,35+,36+,38+,39-,40+,41+/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(CCCCCCCCCCCCCCC)=O)[C@]([H])(O)/C=C/CC/C=C(\C)/C=C/CCCCCCC