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Structure Information
Structure

Compound Identification

SMILES

CC1(C)CC[C@@]2(CC=C3[C@]4(C)CCC5C(C)(C)[C@@H](OC(=O)C6=CC=C(O)C=C6)[C@@H](C[C@]5(C)[C@H]4CC[C@@]3(C)C2C1)OC(=O)C1=CC=C(O)C=C1)C(O)=O

InChIKey

InChIKey=XPEVLOSUULAUFH-QIHLFMPWSA-N

Formula

C44H56O8

Mass

712.924

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Scalarane sesterterpenoid - P-hydroxybenzoic acid alkyl ester - P-hydroxybenzoic acid ester - Benzoate ester - Benzoic acid or derivatives - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Benzenoid - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homopolycyclic 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

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