Compound Identification
SMILES
C[C@H]1C[C@H](C=C(C)C)c2c(C)c(O[C@@H]3OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]3O)c(O)c3[C@@H](C)CC[C@H]1c23
InChIKey
InChIKey=AXXBUCAUNFEVQG-YYQRKLPESA-N
Formula
C29H40O8
Mass
516.631
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
- Class Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Diterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Amphilectane, neoamphilectane, cycloamphilectane, and adociane diterpenoids
Alternative Parents
Tetralins Oxanes Monosaccharides Dicarboxylic acids and derivatives Secondary alcohols Carboxylic acid esters Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Amphilectane, neoamphilectane, cycloamphilectane, or adociane diterpenoid - Tetralin - Benzenoid - Oxane - Monosaccharide - Dicarboxylic acid or derivatives - Secondary alcohol - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as amphilectane, neoamphilectane, cycloamphilectane, and adociane diterpenoids. These are diterpenoids with a structure based on the amphilectane or a seco-,neo-, or cyclo- derivative thereof. Amphilectane is a tricyclic structure made up of three cyclohexane fused together, with a methyl group at the C11-, C7-, and C3- positions. Additionally, it carries a 2-methylpropyl group at the C1-position. Amphilectanes are presumably derived from serrulatanes. Cycloamphilectanes represent a further cyclisation.
External Descriptors
Not available