Structure Information
Structure

Compound Identification

SMILES

CC1(C)OC1[C@H]1C[C@@H](C2CC3(C)CCC4C(=CCC5C(C)(C)C(=O)CC[C@]45C)[C@@]3(C)C2)[C@H](O)O1

InChIKey

InChIKey=REBRTKVBDGTASX-LNSDXBQISA-N

Formula

C30H46O4

Mass

470.694

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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

Not available

Direct Parent

Colensane and clerodane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Clerodane diterpenoid - 3-oxo-delta-7-steroid - 3-oxosteroid - Oxosteroid - Delta-7-steroid - Steroid - Oxolane - Cyclic ketone - Ketone - Hemiacetal - Ether - Oxirane - Dialkyl ether - Oxacycle - Organoheterocyclic compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Carbonyl group - Aldehyde - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as colensane and clerodane diterpenoids. These are diterpenoids with a structure based on the clerodane or the colensane skeleton. Clerodanes arise from labdanes by two methyl migrations.

External Descriptors

Not available

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