CHEBI:229472 - PE-NMe-GlcCer 16:0(3OH,4OH,14Me)/22:0(2OH)

ChEBI IDCHEBI:229472
ChEBI NamePE-NMe-GlcCer 16:0(3OH,4OH,14Me)/22:0(2OH)
Stars
SubmitterMichael Witting
DownloadsMolfile
FormulaC48H97N2O13P
Net Charge0
Average Mass941.279
Monoisotopic Mass940.67283
SMILESCCCCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO[C@@H]1O[C@H](COP(=O)(O)OCCNC)[C@@H](O)[C@H](O)[C@H]1O)C(O)C(O)CCCCCCCCCCC(C)C
InChIInChI=1S/C48H97N2O13P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-27-30-33-41(52)47(57)50-39(43(53)40(51)32-29-26-23-21-20-22-25-28-31-38(2)3)36-60-48-46(56)45(55)44(54)42(63-48)37-62-64(58,59)61-35-34-49-4/h38-46,48-49,51-56H,5-37H2,1-4H3,(H,50,57)(H,58,59)/t39?,40?,41?,42-,43?,44-,45+,46-,48-/m1/s1
InChIKeyDZLAOCGIYCMLMV-ZRUUSKKPSA-N
Species of MetaboliteComponentSourceComments
Caenorhabditis elegans (ncbitaxon:6239) - PubMed (28369040)
ChEBI Ontology
Outgoing Relation(s)
PE-NMe-GlcCer 16:0(3OH,4OH,14Me)/22:0(2OH) (CHEBI:229472) is a organic molecular entity (CHEBI:50860)