Compound Identification
SMILES
CC(C)[C@@H](C)[C@H]1OC(C)(C)O[C@@H]1[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)C[C@H]2OC(C)(C)O[C@H]2C[C@@H]1C(=O)OC3=O
InChIKey
InChIKey=RYMWANMJVFOZBD-SQJPXQTCSA-N
Formula
C34H54O7
Mass
574.799
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Steroids and steroid derivatives
-
Subclass
Steroid lactones
- Level 5 Brassinolides and derivatives
-
Subclass
Steroid lactones
-
Class
Steroids and steroid derivatives
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Steroid lactones
Intermediate Tree Nodes
Not available
Direct Parent
Brassinolides and derivatives
Alternative Parents
Oxepanes Ketals Dicarboxylic acids and derivatives Carboxylic acid anhydrides 1,3-dioxolanes Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Brassinolide-skeleton - Caprolactone - Ketal - Oxepane - Dicarboxylic acid or derivatives - Meta-dioxolane - Carboxylic acid anhydride - Lactone - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Acetal - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as brassinolides and derivatives. These are cholestane based steroid lactones containing benzo[c]indeno[5,4-e]oxepin-3-one.
External Descriptors
Not available