ClassyFire

Compound Identification

SMILES

CCCCCCCCCCCCCCCC(=O)OCC(OC(=O)CCCCCCCCCCCCCCC)C(OC(=O)CCCCCCCCCCCCCCC)[14C](=O)CCCCCCCCCCCCCCC

InChIKey

InChIKey=CYKHAJMUIJYRAS-ZTMMJSMRSA-N

Formula

C67H128O7

Mass

1047.746

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Fatty Acyls
    - Subclass Fatty acid esters
      - Level 5 Wax esters
        
        Level 6 Wax diesters
        
        Level 7 Type 2 wax diesters

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acid esters

Intermediate Tree Nodes

Wax esters - Wax diesters

Direct Parent

Type 2 wax diesters

Alternative Parents

Fatty alcohol esters Tricarboxylic acids and derivatives Alpha-acyloxy ketones Monosaccharides Ketones Carboxylic acid esters Organic oxides Hydrocarbon derivatives

Molecular Framework

Aliphatic acyclic compounds

Substituents

Type 2 wax diester skeleton - Fatty alcohol ester - Tricarboxylic acid or derivatives - Alpha-acyloxy ketone - Monosaccharide - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as type 2 wax diesters. These are waxes based on alkane-1,2-diols (usually C12-C23) esterified with C10-C20 acids at the two hydroxyl groups.

External Descriptors

Not available

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