Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)CO[C@H]2O[C@H]2CC[C@@]3(C)[C@H]4CC[C@@H]5[C@]6(C)C[C@H](O)[C@H]([C@@H]6[C@@H](O)C[C@]5(C)[C@@]4(C)CC(=O)[C@H]3C2(C)C)C(C)(C)O)[C@H](O)[C@H](O)[C@H]1O

InChIKey

InChIKey=PMIQHWRFLIHWFG-KDAHFQLKSA-N

Formula

C41H68O13

Mass

768.982

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Hopanoids

Intermediate Tree Nodes

Not available

Direct Parent

Hopanoids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Triterpenoid - Hopane-skeleton - 20-hydroxysteroid - 14-alpha-methylsteroid - 16-hydroxysteroid - 16-beta-hydroxysteroid - 2-oxosteroid - Oxosteroid - Hydroxysteroid - 12-hydroxysteroid - Steroid - O-glycosyl compound - Glycosyl compound - Disaccharide - Oxane - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Ketone - Oxacycle - Organoheterocyclic compound - Polyol - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hopanoids. These are terpenoids containing hopane skeleton(A'-Neogammacerane), a pentacyclic structure with four cyclohexane rings and one cyclopentane ring (and often, a side chain emerging from C30).

External Descriptors

Not available

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