Compound Identification
SMILES
C\C(=N/OCC1=CC=C(C=C1)C1=CSC=C1)C1=CC=C(CCC(N)(CO)COP(O)(O)=O)C=C1
InChIKey
InChIKey=XNEXJYULZLQMGQ-NLRVBDNBSA-N
Formula
C24H29N2O6PS
Mass
504.54
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Organic phosphoric acids and derivatives
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Subclass
Phosphate esters
- Level 5 Phosphoethanolamines
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Subclass
Phosphate esters
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Class
Organic phosphoric acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic phosphoric acids and derivatives
Subclass
Phosphate esters
Intermediate Tree Nodes
Not available
Direct Parent
Phosphoethanolamines
Alternative Parents
Monoalkyl phosphates Aralkylamines Benzene and substituted derivatives Thiophenes Heteroaromatic compounds 1,2-aminoalcohols Primary alcohols Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phosphoethanolamine - Monoalkyl phosphate - Aralkylamine - Monocyclic benzene moiety - Alkyl phosphate - Benzenoid - Thiophene - Heteroaromatic compound - 1,2-aminoalcohol - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Primary amine - Primary alcohol - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic nitrogen compound - Amine - Alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phosphoethanolamines. These are compounds containing a phosphate linked to the second carbon of an ethanolamine.
External Descriptors
Not available