ethyketazocine - Moligand™ , Agonist of δ receptor;Agonist of κ receptor, CAS No.E610207, Agonist of δ receptor;Agonist of κ receptor

CAS: E610207 Cat. No.: E610207 PubChem CID: 135018

GRADE & PURITY Moligand™

Synonyms

Q27077240 | PDSP2_001344 | PDSP2_001345 | WIN-35,197-2 | DTXSID70276356 | GTPL1610 | EKC | (+/-)-EKC | ethyketazocine | (plusmn)-Ethylketazocine | ETHYLKETOCYCLAZOCINE | (1R,9R,13S)-10-(cyclopropylmethyl)-1-ethyl-4-hydroxy-13-methyl-10-azatricyclo[7.3.1.0

Storage

Room temperature

Specifications

Synonyms

Q27077240 | PDSP2_001344 | PDSP2_001345 | WIN-35, 197-2 | DTXSID70276356 | GTPL1610 | EKC | (+/-)-EKC | ethyketazocine | (plusmn)-Ethylketazocine | ETHYLKETOCYCLAZOCINE | (1R, 9R, 13S)-10-(cyclopropylmethyl)-1-ethyl-4-hydroxy-13-methyl-10-azatricyclo[7.3.1.0

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Action Type

AGONIST

Mechanism of action

Agonist of δ receptor;Agonist of κ receptor

Names and Identifiers

• Canonical Smiles: CC[C@@]12CCN([C@H]([C@H]1C)C(=O)c1c2cc(O)cc1)CC1CC1
• InChIKey: SEJUQQOPVAUETF-QHLBDZCJSA-N
• INCHI: 1S/C19H25NO2/c1-3-19-8-9-20(11-13-4-5-13)17(12(19)2)18(22)15-7-6-14(21)10-16(15)19/h6-7,10,12-13,17,21H,3-5,8-9,11H2,1-2H3/t12-,17-,19-/m1/s1
• Isomeric SMILES: CC[C@@]12CCN([C@H]([C@H]1C)C(=O)C3=C2C=C(C=C3)O)CC4CC4
• PubChem CID: 135018

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Alkaloids and derivatives
    • Class 6,7-benzomorphans
      • Subclass 4-hydroxy-6,7-benzomorphans

• Kingdom: Organic compounds
• Superclass: Alkaloids and derivatives
• Class: 6,7-benzomorphans
• Subclass: 4-hydroxy-6,7-benzomorphans
• Intermediate Tree Nodes: Not available
• Direct Parent: 4-hydroxy-6,7-benzomorphans
• Alternative Parents: Benzazocines Tetralins Aryl alkyl ketones Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Piperidines Trialkylamines Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 4-hydroxy-6,7-benzomorphan - Benzazocine - Tetralin - Aryl ketone - Aryl alkyl ketone - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Piperidine - Benzenoid - Tertiary aliphatic amine - Tertiary amine - Ketone - Organoheterocyclic compound - Azacycle - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as 4-hydroxy-6,7-benzomorphans. These are aromatic heteropolycyclic compounds containing a 6,7-benzomorphan skeleton, which is hydroxylated at the ring 4-position.
• 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.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

OPRD1 Tclin Delta-type opioid receptor (1 Activities)

Discover Target: OPRD1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

OPRK1 Tclin Kappa-type opioid receptor (3 Activities)

Discover Target: OPRK1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)