Compound Identification
SMILES
[3H]C([3H])([3H])O[C@]1([3H])C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)C[C@H](C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C/C=C/C=C(C)/[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@@]3([3H])C(=O)O2)OC)CC([3H])([3H])C1([3H])OCCO
InChIKey
InChIKey=KJKBVFRVQXIQMI-PYICZWKESA-N
Formula
C53H85NO14
Mass
976.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Macrolide lactams
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Macrolide lactams
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Macrolide lactams
Alternative Parents
Alpha amino acid esters Macrolides and analogues Oxanes Piperidines Tertiary carboxylic acid amides Tertiary amines Lactones Lactams Hemiacetals Cyclic ketones Carboxylic acid esters Secondary alcohols Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Macrolide lactam - Alpha-amino acid ester - Macrolide - Alpha-amino acid or derivatives - Oxane - Piperidine - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Hemiacetal - Ketone - Lactam - Lactone - Secondary alcohol - Tertiary amine - Cyclic ketone - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Dialkyl ether - Ether - Organic nitrogen compound - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Alcohol - Carbonyl group - Primary alcohol - Organic oxide - Hydrocarbon derivative - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as macrolide lactams. These are cyclic polyketides containing both a cyclic amide and a cyclic ester group.
External Descriptors
Not available