Compound Identification
SMILES
[I-].CSC1=C2SC(=CN2C=[N+]1CC(=O)N1CCN(CC1)C(=O)OCC1=CC=C(C=C1)[N+]([O-])=O)C1=C(N2[C@@H]([C@@H]([C@@H](C)O)C2=O)[C@H]1C)C(O)=O
InChIKey
InChIKey=UUUUJNLJXMKNPV-KQQKGOQFSA-N
Formula
C30H33IN6O9S2
Mass
812.65
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
- Level 5 Carbapenems
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Subclass
Beta lactams
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Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Not available
Direct Parent
Carbapenems
Alternative Parents
Alpha amino acids and derivatives Benzyloxycarbonyls Piperazine carboxylic acids Nitrobenzenes Pyrroline carboxylic acids Nitroaromatic compounds Alkylarylthioethers Azepines N-substituted imidazoles Thiazoles Tertiary carboxylic acid amides Carbamate esters Heteroaromatic compounds Secondary alcohols Azetidines Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Sulfenyl compounds Carboxylic acids Azacyclic compounds Organic oxoazanium compounds Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organic iodide salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbapenem - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Piperazine-1-carboxylic acid - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Alkylarylthioether - Piperazine - Monocyclic benzene moiety - 1,4-diazinane - N-substituted imidazole - Benzenoid - Azole - Heteroaromatic compound - Pyrroline - Tertiary carboxylic acid amide - Thiazole - Imidazole - Carbamic acid ester - Azetidine - Carboxamide group - Secondary alcohol - C-nitro compound - Organic nitro compound - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Sulfenyl compound - Thioether - Organic oxoazanium - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Organic zwitterion - Organic iodide salt - Organic salt - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as carbapenems. These are beta-lactam derivatives in which the beta-lactam ring shares the nitrogen atom with a pyrrole-2-carboxylic acid.
External Descriptors
Not available