Structure Information
Structure

Compound Identification

SMILES

CC1=C2[C@@H](O)[C@H](O)[C@]3(C)[C@@H](O)C[C@H](O)[C@@](O)(COC(=O)C4=CC=CC=C4)[C@H]3[C@H](O)[C@@]2(C[C@@H]1O)C(C)(C)O

InChIKey

InChIKey=WKVZQSJPGDPXHV-RVYAFRDFSA-N

Formula

C27H38O10

Mass

522.591

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Diterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Taxanes and derivatives

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

11(15->1)-abeotaxane diterpenoid - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Cyclitol or derivatives - Monocyclic benzene moiety - Benzenoid - Tertiary alcohol - Cyclic alcohol - Carboxylic acid ester - Secondary alcohol - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Polyol - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as taxanes and derivatives. These are diterpenoids with a structure based either on the taxane skeleton, or a derivative thereof. In term of phytochemistry, several derivatives of the taxane skeleton exist: 2(3->20)-abeotaxane, 3,11-cyclotaxane, 11(15->1),11(10->9)-abeotaxane, 3,8-seco-taxane, and 11(15->1)-abeotaxane, among others. More complex skeletons have been found recently, which include the taxane-derived [3.3.3] propellane ring system.

External Descriptors

Not available

Previous Back Next