Compound Identification
SMILES
C[C@H]1C[C@H](OC1=O)[C@@H]1CC[C@@H]2[N@@H+]1CCCC[C@@]21C[C@H](C)C(=O)O1
InChIKey
InChIKey=FOGTVYCUHQOMDW-DFIGXFEKSA-O
Formula
C18H28NO4
Mass
322.424
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Stemona alkaloids
-
Subclass
Tuberostemospironine-type alkaloids
- Level 5 Croomine-type alkaloids
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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
Delta amino acids and derivatives Pyrroloazepines Azepanes Dicarboxylic acids and derivatives Gamma butyrolactones N-alkylpyrrolidines Tetrahydrofurans Trialkylamines Carboxylic acid esters Azacyclic compounds Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Organic cations
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Croomine-type alkaloid - Delta amino acid or derivatives - Pyrroloazepine - Azepane - Dicarboxylic acid or derivatives - Gamma butyrolactone - N-alkylpyrrolidine - Pyrrolidine - Tetrahydrofuran - Amino acid or derivatives - Carboxylic acid ester - Lactone - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Azacycle - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Amine - Carbonyl group - Organic oxygen compound - Organic cation - 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