CHEBI:71072 - N-2-hydroxyhexadecanoyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-2-hydroxyhexadecanoyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine
ChEBI ID CHEBI:71072
ChEBI ASCII Name N-2-hydroxyhexadecanoyl-1-O-beta-D-glucosyl-15-methylhexadecasphing-4-enine
Definition An N-acyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine in which the acyl group has 16 carbons and 0 double bonds and is 2-hydroxylated.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter AnneNiknejad
Supplier Information
Download Molfile XML SDF
Formula C39H75NO9
Net Charge 0
Average Mass 702.01410
Monoisotopic Mass 701.54418
InChI InChI=1S/C39H75NO9/c1-4-5-6-7-8-9-10-11-14-18-21-24-27-33(43)38(47)40-31(29-48-39-37(46)36(45)35(44)34(28-41)49-39)32(42)26-23-20-17-15-12-13-16-19-22-25-30(2)3/h23,26,30-37,39,41-46H,4-22,24-25,27-29H2,1-3H3,(H,40,47)/b26-23+/t31-,32+,33?,34+,35+,36-,37+,39+/m0/s1
InChIKey ZYZJNMBJSSYHBT-KJAKCWSYSA-N
SMILES CCCCCCCCCCCCCCC(O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCC(C)C
ChEBI Ontology
Outgoing N-2-hydroxyhexadecanoyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:71072) has functional parent 15-methylhexadecasphing-4-enine (CHEBI:70798)
N-2-hydroxyhexadecanoyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:71072) is a N-acyl-1-O-β-D-glucosyl-15-methylhexadecasphing-4-enine (CHEBI:70815)
Synonym Source
1-O-β-D-glucosyl-N-2-hydroxyhexadecanoyl-15-methylhexadecasphing-4-enine ChEBI
Last Modified
23 November 2012