Compound Identification
SMILES
Cl.OCCCN[C@@H]1C=C[C@H](O)[C@H](O)[C@H]1O
InChIKey
InChIKey=HAHARSLOAUPIDV-BQUBBIKSSA-N
Formula
C9H18ClNO4
Mass
239.7
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 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
Direct Parent
Cyclitols and derivatives
Alternative Parents
1,3-aminoalcohols Secondary alcohols Polyols Dialkylamines Primary alcohols Organopnictogen compounds Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Cyclitol or derivatives - 1,3-aminoalcohol - Secondary alcohol - Secondary amine - Polyol - Secondary aliphatic amine - Alkanolamine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Primary alcohol - Organonitrogen compound - Amine - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cyclitols and derivatives. These are compounds containing a cycloalkane moiety with one hydroxyl group on each of three or more ring atoms. These of also include derivatives where the hydrogen atom of one or more of the hydroxyl groups is replaced with another atom.
External Descriptors
Not available