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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Diterpenoids
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Level 5
Mutilane diterpenoids
- Level 6 Mutilin derivatives
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Level 5
Mutilane diterpenoids
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Subclass
Diterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
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
Benzoic acids and derivatives Phenoxy compounds Methoxybenzenes Benzoyl derivatives Anisoles Alkyl aryl ethers Alkyl phosphates Carbamate esters Ketones Organonitrogen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
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