Terminology Service for NFDI4Health
beta-D-glucosyl-(1<->1')-N-eicosanoylsphinganine
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http://purl.obolibrary.org/obo/CHEBI_84703
A beta-D-glucosyl-(1<->1')-N-acylsphinganine in which the acyl group specified is eicosanoyl.
Term info
Label
beta-D-glucosyl-(1<->1')-N-eicosanoylsphinganine
Synonyms
- N-[(2S,3R)-1-(beta-D-glucopyranosyloxy)-3-hydroxyoctadecan-2-yl]icosanamide
Subsets
3_STAR
charge
0
formula
C44H87NO8
has obo namespace
chebi_ontology
has related synonym
N-(eicosanoyl)-1-beta-glucosyl-sphinganine, C20DH GlcCer, GlcCer(d18:0/20:0)
id
CHEBI:84703
inchi
InChI=1S/C44H87NO8/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-40(48)45-37(36-52-44-43(51)42(50)41(49)39(35-46)53-44)38(47)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h37-39,41-44,46-47,49-51H,3-36H2,1-2H3,(H,45,48)/t37-,38+,39+,41+,42-,43+,44+/m0/s1
inchikey
JMHGBISEAGEKAI-NTSAOYMNSA-N
mass
758.165
monoisotopicmass
757.64317
smiles
[C@H]1([C@H](O[C@@H](OC[C@@H]([C@@H](CCCCCCCCCCCCCCC)O)NC(CCCCCCCCCCCCCCCCCCC)=O)[C@@H]([C@H]1O)O)CO)O