Compound Identification
SMILES
CC1(C)CCC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C[C@@H](O)[C@@]2(C)[C@H]1C[C@H](O)C1=C2[C@H](O)OC1=O
InChIKey
InChIKey=GAQSWPYYPSDAAV-ZIICOCJGSA-N
Formula
C25H38O5
Mass
418.574
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Sesterterpenoids
- Level 5 Scalarane sesterterpenoids
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Subclass
Sesterterpenoids
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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
Sesterterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Scalarane sesterterpenoids
Alternative Parents
Steroid lactones 12-hydroxysteroids 17-oxosteroids 7-hydroxysteroids Oxasteroids and derivatives Butenolides Enoate esters Secondary alcohols Lactones Hemiacetals Cyclic alcohols and derivatives Polyols Oxacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Scalarane sesterterpenoid - Steroid lactone - 12-hydroxysteroid - 15-hydroxysteroid - Hydroxysteroid - 17-oxosteroid - Oxosteroid - 7-hydroxysteroid - 16-oxasteroid - Steroid - 2-furanone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Cyclic alcohol - Dihydrofuran - Secondary alcohol - Lactone - Carboxylic acid ester - Hemiacetal - Polyol - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as scalarane sesterterpenoids. These are sesterterpenoids with a structure based on the scalarane backbone. Scalarane is a tetracyclic compound, which is similar the homoandrostane with five methyl groups at the 4-, 4-, 8-, 17-, 17a-positions.
External Descriptors
Not available