Compound Identification
SMILES
[Cl-].CC[C@@H]1O[C@]2(C[C@@H]3CC[C@@H]4[C@H](C(=O)OCCCCCCCCCCCCCCCC(O)=O)[C@]5(CCC[C@@H](C)O5)NC(N2)=[N+]34)CCC=C1
InChIKey
InChIKey=QTJDIRBCSNGXHV-AIPHRTNUSA-N
Formula
C38H64ClN3O6
Mass
694.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
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Subclass
Fatty acids and conjugates
- Level 5 Long-chain fatty acids
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Subclass
Fatty acids and conjugates
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acids and conjugates
Intermediate Tree Nodes
Not available
Direct Parent
Long-chain fatty acids
Alternative Parents
Heterocyclic fatty acids Oxanes Dicarboxylic acids and derivatives Hydropyrimidines Pyrrolidines Carboxylic acid esters Guanidines Azacyclic compounds Carboximidamides Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Oxacyclic compounds Carbonyl compounds Organopnictogen compounds Organic zwitterions Hydrocarbon derivatives Organic oxides Organic chloride salts
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Long-chain fatty acid - Heterocyclic fatty acid - Dicarboxylic acid or derivatives - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Oxane - Pyrrolidine - Carboxylic acid ester - Guanidine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid - Oxacycle - Organic chloride salt - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organic zwitterion - Organic salt - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms.
External Descriptors
Not available