Compound Identification
SMILES
C[C@@H]1C[C@]2(CCCCN3[C@@H](CC[C@@H]23)C(O)=O)OC1=O
InChIKey
InChIKey=XMPKUGVTKHNSMR-ZHPDPMBESA-N
Formula
C14H21NO4
Mass
267.325
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Stemona 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
Tuberostemospironine-type alkaloids
Alternative Parents
Pyrroloazepines L-alpha-amino acids Pyrrolidine carboxylic acids Azepanes N-alkylpyrrolidines Gamma butyrolactones Dicarboxylic acids and derivatives Oxolanes Trialkylamines Amino acids Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Tuberostemospironine backbone - Alpha-amino acid - Alpha-amino acid or derivatives - Pyrroloazepine - L-alpha-amino acid - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Azepane - Dicarboxylic acid or derivatives - Gamma butyrolactone - N-alkylpyrrolidine - Oxolane - Pyrrolidine - Amino acid - Lactone - Carboxylic acid ester - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Organoheterocyclic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Organic oxygen compound - Organic oxide - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tuberostemospironine-type alkaloids. These are alkaloids with a structure that is characterized by a 2H-spiro[furan-2,9A[9H]pyrrolo[1,2-a]azepin]-\n5-one nucleus which displays a spiro gamma-lactone at C-9 of the basic ring.
External Descriptors
Not available