Structure Information
Structure

Compound Identification

SMILES

C[C@@]1(O)C[C@@]23CC(O)C4(O)C(CC(O)C4(C)C)[C@](C)(O)C2CCC1[C@H]3OC(=O)C1=CC=CC=C1

InChIKey

InChIKey=ILFZIIZVYOINKM-FBGTXLODSA-N

Formula

C27H38O7

Mass

474.594

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Diterpenoids

Intermediate Tree Nodes

Grayanoids

Direct Parent

Leucothol and grayanotoxane diterpenoids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Grayanotoxane diterpenoid - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Monocyclic benzene moiety - Benzenoid - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Carboxylic acid ester - Polyol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organooxygen compound - Alcohol - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as leucothol and grayanotoxane diterpenoids. These are diterpenoids with a structure based either on the leucothol or the grayanotoxane skeleton.

External Descriptors

Not available

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