Compound Identification
SMILES
CCC(=O)O[C@@H](C[C@@H](C)[C@]12CC[C@@]3(C)[C@@]1(C[C@H](OC(=O)CC)[C@H]1[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]31C)O2)[C@@H](OC(=O)CC)C(C)=C
InChIKey
InChIKey=LRSFNIHPMRREOQ-KLTJGCDGSA-N
Formula
C39H60O8
Mass
656.901
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
Steroid esters 3-oxo-5-alpha-steroids Naphthopyrans Naphthalenes Tricarboxylic acids and derivatives Pyrans Oxanes Cyclic ketones Carboxylic acid esters Oxacyclic compounds Epoxides Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Triterpenoid - Steroid ester - 3-oxosteroid - Oxosteroid - 3-oxo-5-alpha-steroid - Steroid - Naphthopyran - Naphthalene - Tricarboxylic acid or derivatives - Pyran - Oxane - Cyclic ketone - Carboxylic acid ester - Ketone - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Oxirane - Ether - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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