Compound Identification
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O[C@@H]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@@]5(CC(O)[C@@H](O)C(O5)[C@H](O)[C@H](O)CO)C(O)=O)C4O)C3NC(C)=O)[C@H](O[C@@]3(CC(O)[C@@H](O)C(O3)[C@H](O)[C@H](O)CO)C(O)=O)C2O)[C@H](O)C1O)[C@H](O)\C=C\CCCCCCCCCCCCC
InChIKey
InChIKey=UDJLBKBEEJJRCU-NDRJUGPRSA-N
Formula
C88H158N2O39
Mass
1868.207
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Sphingolipids
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Subclass
Glycosphingolipids
- Level 5 Neutral glycosphingolipids
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Subclass
Glycosphingolipids
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Class
Sphingolipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Sphingolipids
Subclass
Glycosphingolipids
Intermediate Tree Nodes
Neutral glycosphingolipids
Direct Parent
GalNAcb1-4Galb1-4Glc- (Ganglio series)
Alternative Parents
Glycosyl-N-acylsphingosines Oligosaccharides N-acyl-alpha-hexosamines C-glucuronides Alkyl glycosides C-glycosyl compounds O-glycosyl compounds Ketals Pyrans Dicarboxylic acids and derivatives N-acyl amines Oxanes Acetamides Secondary alcohols Secondary carboxylic acid amides Polyols Carboxylic acids Oxacyclic compounds Hydrocarbon derivatives Primary alcohols Carbonyl compounds Organopnictogen compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Galnacb1-4galb1-4glcb-cer_backbone - Glycosyl-n-acylsphingosine - Oligosaccharide - N-acyl-alpha-hexosamine - Fatty acyl glycoside - C-glucuronide - Alkyl glycoside - C-glycosyl compound - O-glycosyl compound - Glycosyl compound - Ketal - Fatty acyl - Fatty amide - Pyran - N-acyl-amine - Oxane - Dicarboxylic acid or derivatives - Acetamide - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Acetal - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Polyol - Hydrocarbon derivative - Alcohol - Organic oxide - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Primary alcohol - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as galnacb1-4galb1-4glc- (ganglio series). These are neutral glycosphingolipids in which the root sequence is GalNAcb1-4Galb1-4Glc.
External Descriptors
LIPIDMAPS (LMSP0601DE06) : Gangliosides