Compound Identification
SMILES
CO[C@H]1\C=C\O[C@@]2(C)OC3=C(C)C(O)=C4C(=O)C(NC(=O)\C(C)=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(=O)NCC5=CC=C(Cl)C=C5)[C@@H]1C)=C(N1CCOCC1)C(=O)C4=C3C2=O
InChIKey
InChIKey=RMXBOGCYSYTOJH-VPFDJVCCSA-N
Formula
C47H56ClN3O13
Mass
906.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Macrolactams
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Macrolactams
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Macrolactams
Alternative Parents
Naphthofurans Naphthoquinones Benzofurans Coumarans Aryl alkyl ketones Quinones Chlorobenzenes Ketals Aryl chlorides Morpholines Vinylogous acids Carbamate esters Vinylogous amides Trialkylamines Secondary carboxylic acid amides Secondary alcohols Lactams Enamines Dialkyl ethers Oxacyclic compounds Azacyclic compounds Polyols Organochlorides Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Macrolactam - Naphthofuran - Naphthoquinone - Naphthalene - Benzofuran - Coumaran - Quinone - Aryl ketone - Aryl alkyl ketone - Chlorobenzene - Halobenzene - Ketal - Morpholine - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl chloride - Oxazinane - Carbamic acid ester - Vinylogous acid - Vinylogous amide - Ketone - Lactam - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Secondary carboxylic acid amide - Secondary alcohol - Ether - Oxacycle - Acetal - Dialkyl ether - Enamine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Polyol - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Aldehyde - Organic oxide - Organohalogen compound - Organochloride - Amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as macrolactams. These are cyclic amides of amino carboxylic acids, having a 1-azacycloalkan-2-one structure, or analogues having unsaturation or heteroatoms replacing one or more carbon atoms of the ring. They are nitrogen analogues (the a nitrogen atom replacing the o atom of the cyclic carboxylic acid group ) of the naturally occurring macrolides.
External Descriptors
Not available