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9Nfy3MS3SL , Ghrelin receptor agonist, CAS No.1008993-65-4, Ghrelin receptor agonist
Basic Description
Synonyms
TZP-102 | CHEMBL4594424 | UNII-9NFY3MS3SL | SCHEMBL804626 | 9NFY3MS3SL | D-Leucine, (2S)-N-((2R)-2-(2-((3S)-3-aminobutyl)phenoxy)propyl)-2-cyclopropylglycyl-N-methyl-D-alanyl-, (3->1)-lactam
Action Type
AGONIST
Mechanism of action
Ghrelin receptor agonist
Taxonomic Classification
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
Macrolactams Alpha amino acids and derivatives Alkyl aryl ethers Benzenoids Tertiary carboxylic acid amides Secondary carboxylic acid amides Lactams Oxacyclic compounds Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-oligopeptide - Macrolactam - Alpha-amino acid or derivatives - Alkyl aryl ether - Benzenoid - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Lactam - Secondary carboxylic acid amide - Secondary aliphatic amine - Ether - Oxacycle - Azacycle - Secondary amine - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - 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
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
IUPAC Name
(3R,6S,9R,12R,15S)-6-cyclopropyl-3,8,9,15-tetramethyl-12-(2-methylpropyl)-2-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),18,20-triene-7,10,13-trione
INCHI
InChI=1S/C28H44N4O4/c1-17(2)15-23-27(34)30-18(3)11-12-21-9-7-8-10-24(21)36-19(4)16-29-25(22-13-14-22)28(35)32(6)20(5)26(33)31-23/h7-10,17-20,22-23,25,29H,11-16H2,1-6H3,(H,30,34)(H,31,33)/t18-,19+,20+,23+,25-/m0/s1
InChIKey
HIIMPSTXUQUYOO-FPJBJBNZSA-N
Smiles
CC1CCC2=CC=CC=C2OC(CNC(C(=O)N(C(C(=O)NC(C(=O)N1)CC(C)C)C)C)C3CC3)C
Isomeric SMILES
C[C@H]1CCC2=CC=CC=C2O[C@@H](CN[C@H](C(=O)N([C@@H](C(=O)N[C@@H](C(=O)N1)CC(C)C)C)C)C3CC3)C
PubChem CID
24875372
Molecular Weight
500.7
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
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