(-)-cyclazocine - Moligand™ , Agonist of δ receptor;Agonist of κ receptor;Agonist of μ receptor, CAS No.7313-86-2, Agonist of δ receptor;Agonist of κ receptor;Agonist of μ receptor

CAS: 7313-86-2 Cat. No.: C609683 Molecular Weight: 271.4 PubChem CID: 21779964

GRADE & PURITY Moligand™

Synonyms

(2S,6R)-3-(Cyclopropylmethyl)-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocin-8-ol | DTXSID20617937 | GTPL1604 | (1R,9S)-10-(cyclopropylmethyl)-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol | AKOS030242899 | (1R,9S)-10-(

Storage

Room temperature

Specifications

Synonyms

(2S, 6R)-3-(Cyclopropylmethyl)-6, 11-dimethyl-1, 2, 3, 4, 5, 6-hexahydro-2, 6-methano-3-benzazocin-8-ol | DTXSID20617937 | GTPL1604 | (1R, 9S)-10-(cyclopropylmethyl)-1, 13-dimethyl-10-azatricyclo[7.3.1.02, 7]trideca-2(7), 3, 5-trien-4-ol | AKOS030242899 | (1R, 9S)-10-(

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Action Type

AGONIST

Mechanism of action

Agonist of δ receptor;Agonist of κ receptor;Agonist of μ receptor

Names and Identifiers

• Canonical Smiles: CC1C2CC3=C(C1(CCN2CC4CC4)C)C=C(C=C3)O
• IUPAC Name: (1R,9S)-10-(cyclopropylmethyl)-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol
• InChIKey: YQYVFVRQLZMJKJ-OTLVQASYSA-N
• INCHI: 1S/C18H25NO/c1-12-17-9-14-5-6-15(20)10-16(14)18(12,2)7-8-19(17)11-13-3-4-13/h5-6,10,12-13,17,20H,3-4,7-9,11H2,1-2H3/t12?,17-,18+/m0/s1
• Isomeric SMILES: CC1[C@@H]2CC3=C([C@@]1(CCN2CC4CC4)C)C=C(C=C3)O
• PubChem CID: 21779964
• Molecular Weight: 271.4

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Alkaloids and derivatives
    • Class 6,7-benzomorphans
      • Subclass 2,6-dimethyl-3-benzazocines

• Kingdom: Organic compounds
• Superclass: Alkaloids and derivatives
• Class: 6,7-benzomorphans
• Subclass: 2,6-dimethyl-3-benzazocines
• Intermediate Tree Nodes: Not available
• Direct Parent: 2,6-dimethyl-3-benzazocines
• Alternative Parents: 4-hydroxy-6,7-benzomorphans Benzazocines Tetralins Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Piperidines Trialkylamines Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 2,6-dimethyl-3-benzazocine - 4-hydroxy-6,7-benzomorphan - Benzazocine - Tetralin - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Piperidine - Benzenoid - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as 2,6-dimethyl-3-benzazocines. These are aromatic compounds containing a 6,7-benzomorphan skeleton, which is substituted by methyl group at the 2- and 6-positions.
• 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 (1 Activities)

Discover Target: OPRK1

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

OPRM1 Tclin Mu-type opioid receptor (1 Activities)

Discover Target: OPRM1

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