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CHEBI:73872 - N-{β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc}-DHPE

ChEBI IDCHEBI:73872
ChEBI NameN-{β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc}-DHPE
Stars
ASCII NameN-{beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc}-DHPE
DefinitionAn N-glycosylated dialkylglycerophosphoethanolamine in which the alkyl groups are hexadecyl, the glycerol core has sn stereochemistry and the phosphoethanolamine unit is at position 3 and substituted on nitrogen with the branched heptasaccharide β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc.
Last Modified31 May 2013
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC85H157N4O41P
Net Charge0
Average Mass1922.152
Monoisotopic Mass1921.00609
SMILES[H][C@@](COCCCCCCCCCCCCCCCC)(COP(=O)(O)OCCNC1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@H]1NC(C)=O)OCCCCCCCCCCCCCCCC
InChIInChI=1S/C85H157N4O41P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-35-114-44-50(115-36-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)45-118-131(112,113)117-37-34-86-79-58(87-47(3)96)65(103)74(54(41-93)119-79)126-80-59(88-48(4)97)66(104)76(56(43-95)123-80)128-84-73(111)77(64(102)57(125-84)46-116-82-71(109)68(106)61(99)51(38-90)120-82)129-85-78(70(108)63(101)53(40-92)122-85)130-81-60(89-49(5)98)67(105)75(55(42-94)124-81)127-83-72(110)69(107)62(100)52(39-91)121-83/h50-86,90-95,99-111H,6-46H2,1-5H3,(H,87,96)(H,88,97)(H,89,98)(H,112,113)/t50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62+,63-,64-,65-,66-,67-,68+,69+,70+,71+,72-,73+,74-,75-,76-,77+,78+,79?,80+,81+,82+,83+,84+,85-/m1/s1
InChIKeyXLSAFWDRTNNRPE-MUGFWGHISA-N
ChEBI Ontology
Outgoing Relation(s)
N-{β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc}-DHPE (CHEBI:73872) has functional parent 1,2-dihexadecyl-sn-glycero-3-phosphoethanolamine (CHEBI:73859)
N-{β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→6)]-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc}-DHPE (CHEBI:73872) is a N-glycosylated dialkylglycerophosphoethanolamine (CHEBI:73866)
IUPAC Name 
2-[β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-α-D-mannopyranosyl-(1→3)-[α-D-mannopyranosyl-(1→6)]-β-D-mannopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-2-acetamido-2-deoxy-D-glucopyranosylamino]ethyl (2S)-2,3-bis(hexadecyloxy)propyl hydrogen phosphate
Citations