Compound Identification
SMILES
C[C@H]1C2C(CC3C4CCC5C[C@H](O)[C@H](O)C[C@]5(C)C4CC[C@]23C)OC11OC[C@@H](C)CC1=O
InChIKey
InChIKey=NJNHLOAKBXWXGC-UMDBGRFMSA-N
Formula
C27H42O5
Mass
446.628
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
Spirostanes and derivatives 3-alpha-hydroxysteroids Ketals Oxanes Tetrahydrofurans Secondary alcohols Ketones Cyclic alcohols and derivatives 1,2-diols Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpenoid - Spirostane skeleton - 3-alpha-hydroxysteroid - Hydroxysteroid - 2-hydroxysteroid - 3-hydroxysteroid - Steroid - Ketal - Oxane - Tetrahydrofuran - Cyclic alcohol - Secondary alcohol - Ketone - 1,2-diol - Oxacycle - Organoheterocyclic compound - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic 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