Structure Information
Structure

Compound Identification

SMILES

[Na+].[Na+].COC1=CC=C(C=C1)C(=O)NC(=O)O[C@@H]1C[C@@](C)(C=C)[C@@H](OP([O-])([O-])=O)[C@H](C)[C@]23CCC(=O)[C@@H]2[C@@]1(C)[C@H](C)CC3

InChIKey

InChIKey=MLDLWUMNAVKCNA-ZVYWFDPJSA-L

Formula

C29H38NNa2O9P

Mass

621.574

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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

Mutilane diterpenoids

Direct Parent

Mutilin derivatives

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Mutilin skeleton - Benzoic acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Organic phosphoric acid derivative - Alkyl phosphate - Phosphoric acid ester - Carbamic acid ester - Ketone - Organic alkali metal salt - Carboxylic acid derivative - Ether - Organic salt - Organic sodium salt - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as mutilin derivatives. These are tricyclic diterpenoids structurally characterized by the presence of a 1-oxo-decahydro-3a,9-propanocyclopenta[8]annulene skeleton.

External Descriptors

Not available

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