CHEBI:140520 - 4-hydroxy-15-methylhexadecasphinganine-phosphocholine(1+)

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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 4-hydroxy-15-methylhexadecasphinganine-phosphocholine(1+)
ChEBI ID CHEBI:140520
Stars This entity has been manually annotated by a third party.
Submitter Michael Witting
Supplier Information
Download Molfile XML SDF
Formula C22H50N2O6P
Net Charge +1
Average Mass 469.617
Monoisotopic Mass 469.34010
InChI InChI=1S/C22H49N2O6P/c1-19(2)14-12-10-8-6-7-9-11-13-15-21(25)22(26)20(23)18-30-31(27,28)29-17-16-24(3,4)5/h19-22,25-26H,6-18,23H2,1-5H3/p+1/t20-,21+,22-/m0/s1
InChIKey BYKMNFCMQXKEQJ-BDTNDASRSA-O
SMILES CC(C)CCCCCCCCCC[C@@H](O)[C@@H](O)[C@@H]([NH3+])COP([O-])(=O)OCC[N+](C)(C)C
ChEBI Ontology
Outgoing 4-hydroxy-15-methylhexadecasphinganine-phosphocholine(1+) (CHEBI:140520) is a organic molecular entity (CHEBI:50860)