Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1C[C@@H]2O[C@@]3(C1)CC1O[C@@]4(CC[C@@]5(O4)OC(CC[C@]5(C)O)CC(=C)CCCC4=[NH+]C[C@@H](C)C(C)C[C@]44CCC(=CC4C2O3)C(=O)CCC([O-])=O)CC(C)C1O

InChIKey

InChIKey=MRPUCWZEBLNKPU-LLVUEOEESA-N

Formula

C45H67NO10

Mass

782.028

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Keto acids and derivatives

Subclass

Gamma-keto acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Gamma-keto acids and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Gamma-keto acid - Azepine - Ketal - Heterocyclic fatty acid - Hydroxy fatty acid - Oxepane - Short-chain keto acid - Fatty acyl - Oxane - Meta-dioxolane - Oxolane - Tertiary alcohol - Carboxylic acid salt - Ketone - Secondary alcohol - Acetal - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Alcohol - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic salt - Organic nitrogen compound - Organopnictogen compound - Organic zwitterion - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as gamma-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C4 carbon atom.

External Descriptors

Not available

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