Compound Identification
SMILES
OCC(O)C(O)C(O)C(O)CNC(=O)C(CCCCNC(=O)CCCOC1=C(CCC(O)=O)C(OCCCCCOC2=CC(=CC(=N2)C2=CC=CC=C2)C2=CC=CC=C2)=CC=C1)NC(=O)C1=CN=C(N\N=C\C2=CC=CC=C2S(O)(=O)=O)C=C1
InChIKey
InChIKey=MSGWWDGSUSVQEN-VPUHOJGASA-N
Formula
C60H71N7O16S
Mass
1178.32
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid amides Phenylpyridines Phenylpropanoic acids Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Nicotinamides Phenoxy compounds Phenol ethers Alkyl aryl ethers N-acyl amines Monosaccharides Imidolactams Sulfonyls Organosulfonic acids Heteroaromatic compounds 1,2-diols Secondary carboxylic acid amides Secondary alcohols Monocarboxylic acids and derivatives Hydrazones Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Primary alcohols Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - 2-phenylpyridine - 4-phenylpyridine - 3-phenylpropanoic-acid - Benzenesulfonate - Arylsulfonic acid or derivatives - Nicotinamide - Benzenesulfonyl group - Pyridine carboxylic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Phenoxy compound - Phenol ether - Alkyl aryl ether - Benzenoid - Fatty acyl - N-acyl-amine - Monosaccharide - Fatty amide - Monocyclic benzene moiety - Pyridine - Imidolactam - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - 1,2-diol - Azacycle - Organoheterocyclic compound - Polyol - Carboxylic acid - Ether - Hydrazone - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Primary alcohol - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available