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

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name PE-NMe-GlcCer 16:0(3OH,4OH,14Me)/22:0(2OH)
ChEBI ID CHEBI:229472
Stars This entity has been manually annotated by a third party.
Submitter Michael Witting
Supplier Information
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Formula C48H97N2O13P
Net Charge 0
Average Mass 941.279
Monoisotopic Mass 940.67283
InChI InChI=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
InChIKey DZLAOCGIYCMLMV-ZRUUSKKPSA-N
SMILES CCCCCCCCCCCCCCCCCCCCC(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
Metabolite of Species Details
Caenorhabditis elegans (NCBI:txid6239) See: PubMed
ChEBI Ontology
Outgoing PE-NMe-GlcCer 16:0(3OH,4OH,14Me)/22:0(2OH) (CHEBI:229472) is a organic molecular entity (CHEBI:50860)