Compound Identification
SMILES
COC1=CC=C(CCOCC(=C)[C@@H]2CC[C@@]3(CC[C@]4(C)[C@H](CC[C@@H]5[C@@]6(C)CC[C@H](O)C(C)(C)[C@@H]6CC[C@@]45C)[C@@H]23)C(=O)N[C@@H](CC(C)C)C(O)=O)C=C1
InChIKey
InChIKey=APORTDNUMQRETM-KGBDUKJHSA-N
Formula
C45H69NO6
Mass
720.048
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Triterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Triterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Triterpenoids
Alternative Parents
Oxosteroids Leucine and derivatives N-acyl-L-alpha-amino acids Naphthalenecarboxamides Tyrosols and derivatives Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Secondary carboxylic acid amides Cyclic alcohols and derivatives Secondary alcohols Monocarboxylic acids and derivatives Dialkyl ethers Carboxylic acids Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Triterpenoid - 18-oxosteroid - Oxosteroid - Steroid - Leucine or derivatives - N-acyl-alpha amino acid or derivatives - 2-naphthalenecarboxamide - N-acyl-l-alpha-amino acid - N-acyl-alpha-amino acid - Tyrosol derivative - Alpha-amino acid or derivatives - Methoxybenzene - Anisole - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Cyclic alcohol - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Organonitrogen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units.
External Descriptors
Not available