Compound Identification
SMILES
C[C@H]1C[C@H](OC1=O)[C@@H]1CC[C@@H]2N1CCCC[C@]21OC(=O)[C@H](C)[C@H]1O
InChIKey
InChIKey=UWDIPKSFCOQITE-PDKNDOMISA-N
Formula
C18H27NO5
Mass
337.416
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Stemona alkaloids
-
Subclass
Tuberostemospironine-type alkaloids
- Level 5 Croomine-type alkaloids
-
Subclass
Tuberostemospironine-type alkaloids
-
Class
Stemona alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Stemona alkaloids
Subclass
Tuberostemospironine-type alkaloids
Intermediate Tree Nodes
Not available
Direct Parent
Croomine-type alkaloids
Alternative Parents
Pyrroloazepines Azepanes N-alkylpyrrolidines Gamma butyrolactones Dicarboxylic acids and derivatives Oxolanes Trialkylamines Secondary alcohols Carboxylic acid esters Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Croomine-type alkaloid - Pyrroloazepine - Azepane - Dicarboxylic acid or derivatives - Gamma butyrolactone - N-alkylpyrrolidine - Oxolane - Pyrrolidine - Amino acid or derivatives - Carboxylic acid ester - Lactone - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Organic oxide - Organic oxygen compound - Alcohol - Organic nitrogen compound - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as croomine-type alkaloids. These are stemona alkaloids with a structure containing a pyrrolo[1,2-a]azepine group, where the azepine moiety forms a spiro system with oxolane-5-one to give spiro[oxolane-2,9'-pyrrolo[1,2-a]azepine]-5-one. Moreover, another 5-oxooxolane moiety attached to the pyrrole ring.
External Descriptors
Not available