Compound Identification
SMILES
[H][C@]12C[C@]3([H])O[C@@]1(CC[C@@]1([H])C(=O)[C@]45C[C@@]1([H])C[C@]([H])(O)[C@@]4([H])[C@]1(C)CC[C@]([H])(O)C(C)(C)[C@@]1([H])[C@@]([H])(OC(C)=O)[C@]5([H])O)C(=O)[C@@]1(C2)[C@@]([H])(O)[C@]([H])(OC(C)=O)[C@]2([H])C(C)(C)[C@@]([H])(O)CC[C@@]2(C)[C@]31[H]
InChIKey
InChIKey=ABEHTYATXMEPJV-RBKWBPHESA-N
Formula
C44H64O12
Mass
784.984
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
Naphthopyrans Naphthalenes Oxepanes Pyrans Oxanes Dicarboxylic acids and derivatives Tetrahydrofurans Secondary alcohols Carboxylic acid esters Ketones Cyclic alcohols and derivatives Polyols Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpenoid - Naphthopyran - Naphthalene - Oxepane - Dicarboxylic acid or derivatives - Pyran - Oxane - Cyclic alcohol - Tetrahydrofuran - Carboxylic acid ester - Ketone - Secondary alcohol - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Polyol - Hydrocarbon derivative - Carbonyl group - Alcohol - Organic oxygen compound - Organic oxide - Organooxygen compound - 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