Compound Identification
SMILES
[Cl-].CN(C)C1=CC=C(C=C1)C(C1=CC=C(C=C1)C(=O)NCCCOP(O)(=O)O[C@@H]1[C@H](O)[C@H](O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@H]1O)=C1C=CC(C=C1)=[N+](C)C
InChIKey
InChIKey=DMCFUCMBEMOVAZ-BEPSMKMQSA-N
Formula
C33H45ClN3O16P3
Mass
868.1
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Alcohols and polyols
-
Level 5
Cyclic alcohols and derivatives
-
Level 6
Cyclitols and derivatives
- Level 7 Inositol phosphates
-
Level 6
Cyclitols and derivatives
-
Level 5
Cyclic alcohols and derivatives
-
Subclass
Alcohols and polyols
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Alcohols and polyols
Intermediate Tree Nodes
Cyclic alcohols and derivatives - Cyclitols and derivatives
Direct Parent
Inositol phosphates
Alternative Parents
Diphenylmethanes Benzamides Aniline and substituted anilines Benzoyl derivatives Dialkylarylamines Monoalkyl phosphates Dialkyl phosphates Cyclohexanols Secondary ketimines Azomethines Secondary carboxylic acid amides Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Polyols Hydrocarbon derivatives Organic chloride salts Organic oxides Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Inositol phosphate - Diphenylmethane - Benzamide - Benzoic acid or derivatives - Tertiary aliphatic/aromatic amine - Benzoyl - Dialkylarylamine - Aniline or substituted anilines - Cyclohexanol - Dialkyl phosphate - Monoalkyl phosphate - Benzenoid - Alkyl phosphate - Organic phosphoric acid derivative - Phosphoric acid ester - Monocyclic benzene moiety - Azomethine - Secondary ketimine - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Secondary alcohol - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Polyol - Organic nitrogen compound - Amine - Organic salt - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organopnictogen compound - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as inositol phosphates. These are compounds containing a phosphate group attached to an inositol (or cyclohexanehexol) moiety.
External Descriptors
Not available