Compound Identification
SMILES
CC1[C@H]2CC[C@]34CCC[C@H]3[C@@]3(CCCOCC5=CC=CC=C5)[C@@H]([C@H](CC[C@@]23C)C(C)(C)O)N14
InChIKey
InChIKey=AQTWPQFSBAMXBG-WTGHACKPSA-N
Formula
C30H45NO2
Mass
451.695
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Daphniphylline-type alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Daphniphylline-type alkaloids
Alternative Parents
Sesquiterpenoids Azaspirodecane derivatives Indolizidines Indoles and derivatives Benzylethers Azepanes Piperidines N-alkylpyrrolidines Tertiary alcohols 1,3-aminoalcohols Trialkylamines Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Daphniphylline-type alkaloid - Sesquiterpenoid - Azaspirodecane - Benzylether - Indole or derivatives - Indolizidine - Azepane - Monocyclic benzene moiety - Piperidine - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Tertiary alcohol - 1,3-aminoalcohol - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Ether - Dialkyl ether - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as daphniphylline-type alkaloids. These are alkaloids (or derivatives thereof) from the genus Daphniphyllum, possessing 22 carbon polycyclic fused ring systems with or without the C8 side chain. The C8 unit consists of 6-oxabicyclo[3.2.1]octane or 2,8-dioxabicyclo[3.2.1]octane.
External Descriptors
Not available