LIPID MAPS

Structure Database (LMSD)

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Common Name

omega-linoleoyloxy-Cer(d18:0/30:0)

Systematic Name

N-(30-(9Z,12Z-octadecadienoyloxy)-triacontanoyl)-sphinganine

Synonyms

Cer[EODS]
N-(30-linoleoyloxy-triacontanoyl)-sphinganine
N-(30-linoleoyloxy-triacontanoyl)-dihydrosphingosine
Cer(d18:0/30:0
18:2(9Z,12Z))

LM ID

LMSP02040106

Formula

C₆₆H₁₂₇NO₅

Exact Mass

Calculate m/z

1013.971424

Sum Composition

ACer 66:2;O3

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Comments

Submitted by J.Wray

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Homo sapiens (#9606)

Mammalia (#40674)

Unpublished data from J. Wray, Univ Manchester

String Representations

InChiKey (Click to copy)

MQTCNSAXDVIJRQ-WQNRZITFSA-N

InChi (Click to copy)

InChI=1S/C66H127NO5/c1-3-5-7-9-11-13-15-17-31-36-40-44-48-52-56-60-66(71)72-61-57-53-49-45-41-37-33-30-28-26-24-22-20-18-19-21-23-25-27-29-32-35-39-43-47-51-55-59-65(70)67-63(62-68)64(69)58-54-50-46-42-38-34-16-14-12-10-8-6-4-2/h11,13,17,31,63-64,68-69H,3-10,12,14-16,18-30,32-62H2,1-2H3,(H,67,70)/b13-11-,31-17-/t63-,64+/m0/s1

SMILES (Click to copy)

[C@](CO)([H])(NC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(CCCCCCC/C=C\C/C=C\CCCCC)=O)=O)[C@]([H])(O)CCCCCCCCCCCCCCC