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862073-77-6,MFCD10574986
Catalog No.:AA01ENEC

862073-77-6 | Herkinorin

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$263.00   $184.00
- +
5mg
≥98%
in stock  
$1,098.00   $768.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01ENEC
Chemical Name:
Herkinorin
CAS Number:
862073-77-6
Molecular Formula:
C28H30O8
Molecular Weight:
494.5330
MDL Number:
MFCD10574986
SMILES:
COC(=O)[C@@H]1C[C@H](OC(=O)c2ccccc2)C(=O)[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)C[C@H](OC1=O)c1ccoc1
Properties
Computed Properties
 
Complexity:
909  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
7  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.2  

Literature

Title: Mitragynine/Corynantheidine Pseudoindoxyls As Opioid Analgesics with Mu Agonism and Delta Antagonism, Which Do Not Recruit β-Arrestin-2.

Journal: Journal of medicinal chemistry 20160922

Title: Antinociceptive effects of herkinorin, a MOP receptor agonist derived from salvinorin A in the formalin test in rats: new concepts in mu opioid receptor pharmacology: from a symposium on new concepts in mu-opioid pharmacology.

Journal: Drug and alcohol dependence 20120301

Title: Consensus 3D model of μ-opioid receptor ligand efficacy based on a quantitative Conformationally Sampled Pharmacophore.

Journal: The journal of physical chemistry. B 20110609

Title: Identification of a novel 'almost neutral' micro-opioid receptor antagonist in CHO cells expressing the cloned human mu-opioid receptor.

Journal: Synapse (New York, N.Y.) 20100401

Title: The effects of herkinorin, the first mu-selective ligand from a salvinorin A-derived scaffold, in a neuroendocrine biomarker assay in nonhuman primates.

Journal: The Journal of pharmacology and experimental therapeutics 20081001

Title: Differential effects of opioid agonists on G protein expression in CHO cells expressing cloned human opioid receptors.

Journal: Brain research bulletin 20080905

Title: Herkinorin analogues with differential beta-arrestin-2 interactions.

Journal: Journal of medicinal chemistry 20080424

Title: Synthetic studies of neoclerodane diterpenes from Salvia divinorum: exploration of the 1-position.

Journal: Bioorganic & medicinal chemistry letters 20071115

Title: A comparison of noninternalizing (herkinorin) and internalizing (DAMGO) mu-opioid agonists on cellular markers related to opioid tolerance and dependence.

Journal: Synapse (New York, N.Y.) 20070301

Title: An opioid agonist that does not induce mu-opioid receptor--arrestin interactions or receptor internalization.

Journal: Molecular pharmacology 20070201

Title: Synthesis of salvinorin A analogues as opioid receptor probes.

Journal: Journal of natural products 20060601

Title: Neoclerodane diterpenes as a novel scaffold for mu opioid receptor ligands.

Journal: Journal of medicinal chemistry 20050728

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SDS
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Tags:862073-77-6 Molecular Formula|862073-77-6 MDL|862073-77-6 SMILES|862073-77-6 Herkinorin
Catalog No.: AA01ENEC
862073-77-6,MFCD10574986
862073-77-6 | Herkinorin
Pack Size： 1mg
Purity： ≥98%
in stock
$263.00 $184.00
Pack Size： 5mg
Purity： ≥98%
in stock
$1,098.00 $768.00
Quantity
- +
Add to Card
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Technical Information
Catalog Number: AA01ENEC
Chemical Name: Herkinorin
CAS Number: 862073-77-6
Molecular Formula: C28H30O8
Molecular Weight: 494.5330
MDL Number: MFCD10574986
SMILES: COC(=O)[C@@H]1C[C@H](OC(=O)c2ccccc2)C(=O)[C@H]2[C@@]1(C)CC[C@@H]1[C@]2(C)C[C@H](OC1=O)c1ccoc1
Properties
Complexity: 909  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 7  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 36  
Hydrogen Bond Acceptor Count: 8  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.2  
Literature fold

Title: Mitragynine/Corynantheidine Pseudoindoxyls As Opioid Analgesics with Mu Agonism and Delta Antagonism, Which Do Not Recruit β-Arrestin-2.

Journal: Journal of medicinal chemistry20160922

Title: Antinociceptive effects of herkinorin, a MOP receptor agonist derived from salvinorin A in the formalin test in rats: new concepts in mu opioid receptor pharmacology: from a symposium on new concepts in mu-opioid pharmacology.

Journal: Drug and alcohol dependence20120301

Title: Consensus 3D model of μ-opioid receptor ligand efficacy based on a quantitative Conformationally Sampled Pharmacophore.

Journal: The journal of physical chemistry. B20110609

Title: Identification of a novel 'almost neutral' micro-opioid receptor antagonist in CHO cells expressing the cloned human mu-opioid receptor.

Journal: Synapse (New York, N.Y.)20100401

Title: The effects of herkinorin, the first mu-selective ligand from a salvinorin A-derived scaffold, in a neuroendocrine biomarker assay in nonhuman primates.

Journal: The Journal of pharmacology and experimental therapeutics20081001

Title: Differential effects of opioid agonists on G protein expression in CHO cells expressing cloned human opioid receptors.

Journal: Brain research bulletin20080905

Title: Herkinorin analogues with differential beta-arrestin-2 interactions.

Journal: Journal of medicinal chemistry20080424

Title: Synthetic studies of neoclerodane diterpenes from Salvia divinorum: exploration of the 1-position.

Journal: Bioorganic & medicinal chemistry letters20071115

Title: A comparison of noninternalizing (herkinorin) and internalizing (DAMGO) mu-opioid agonists on cellular markers related to opioid tolerance and dependence.

Journal: Synapse (New York, N.Y.)20070301

Title: An opioid agonist that does not induce mu-opioid receptor--arrestin interactions or receptor internalization.

Journal: Molecular pharmacology20070201

Title: Synthesis of salvinorin A analogues as opioid receptor probes.

Journal: Journal of natural products20060601

Title: Neoclerodane diterpenes as a novel scaffold for mu opioid receptor ligands.

Journal: Journal of medicinal chemistry20050728

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