Compound Identification
SMILES
CC[C@@]1(C)OC2=C(OCC3=CC=CC=C3)C=CC(=C2)[C@@H](O)[C@H](NS(=O)(=O)C2=CC=C(C=C2)[N+]([O-])=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]1C(=O)NCC(=O)OCC1=CC=CC=C1
InChIKey
InChIKey=SMOQQGSIDDBIGP-VYUQIKSWSA-N
Formula
C42H47N5O12S
Mass
845.92
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Peptides
- Level 6 Oligopeptides
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Level 5
Peptides
-
Subclass
Amino acids, peptides, and analogues
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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
Peptides
Direct Parent
Oligopeptides
Alternative Parents
Cyclic peptides Macrolactams N-acyl-alpha amino acids and derivatives Alpha amino acid esters Benzyloxycarbonyls Benzenesulfonamides Benzenesulfonyl compounds Nitrobenzenes Phenol ethers Nitroaromatic compounds Alkyl aryl ethers Organosulfonamides Aminosulfonyl compounds Secondary carboxylic acid amides Lactams Secondary alcohols Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-oligopeptide - Cyclic alpha peptide - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Macrolactam - Alpha-amino acid or derivatives - Benzenesulfonamide - Benzyloxycarbonyl - Nitrobenzene - Benzenesulfonyl group - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Secondary alcohol - C-nitro compound - Carboxamide group - Secondary carboxylic acid amide - Organic nitro compound - Carboxylic acid ester - Lactam - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organopnictogen compound - Organic salt - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Organic zwitterion - Organosulfur compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oligopeptides. These are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds.
External Descriptors
Not available