Compound Identification
SMILES
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OCC6=CN(N=N6)C6=CC=CC(CO)=C6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
InChIKey
InChIKey=ZOPCSEXIYNWPNP-BJMSDPACSA-N
Formula
C40H57N3O4
Mass
643.913
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Triterpenoids
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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
18-hydroxysteroids Oxosteroids Phenyl-1,2,3-triazoles Benzyl alcohols Heteroaromatic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Dialkyl ethers Hydrocarbon derivatives Organic oxides Carbonyl compounds Organonitrogen compounds Organopnictogen compounds Aromatic alcohols Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triterpenoid - 18-hydroxysteroid - 18-oxosteroid - Hydroxysteroid - Oxosteroid - Steroid - Phenyl-1,2,3-triazole - Phenyltriazole - Benzyl alcohol - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Triazole - 1,2,3-triazole - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organopnictogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Primary alcohol - Alcohol - Aromatic alcohol - Aromatic heteropolycyclic 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