Effusol - Moligand™, ≥98% , CAS No.73166-28-6

CAS: 73166-28-6 Cat. No.: E650958 Formule: C₁₇H₁₆O₂ Poids moléculaire: 252.31 PubChem CID: 100801

GRADE & PURITY Moligand™, ≥98%

Synonyms

NSC 371300 | HY-N5130 | NSC371300 | NSC-371300 | 1-methyl-5-vinyl-9,10-dihydrophenanthrene-2,7-diol | 5-Ethenyl-9,10-dihydro-1-methyl-2,7-phenanthrenediol | S436Y000RU | AKOS040760375 | MS-23564 | FT-0667825 | DTXSID00223419 | 5-ethenyl-1-methyl-9,10-dihy

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Vue d’ensemble

Effusol, a phenolic constituent from Juncus effuses , exhibits potent scavenging activity for DPPH and ABTS radicals, with IC 50 values of 79 μM and 2.73 μM, respectively. Effusol rescues CA1 LTP attenuated by corticosterone, defending the hippocampal function against stress-induced cognitive decline.

Form:Solid

Specifications

Synonymes

NSC 371300 | HY-N5130 | NSC371300 | NSC-371300 | 1-methyl-5-vinyl-9,10-dihydrophenanthrene-2,7-diol | 5-Ethenyl-9,10-dihydro-1-methyl-2,7-phenanthrenediol | S436Y000RU | AKOS040760375 | MS-23564 | FT-0667825 | DTXSID00223419 | 5-ethenyl-1-methyl-9,10-dihy

Spécifications et pureté

Moligand™, ≥98%

Mécanismes biochimiques et physiologiques

Effusol, a phenolic constituent from Juncus effuses , exhibits potent scavenging activity for DPPH and ABTS radicals, with IC 50 values of 79 μM and 2.73 μM, respectively. Effusol rescues CA1 LTP attenuated by corticosterone, defending the hippocampal fun

Conditions de stockage de stockage

Protected from light,Store at -20°C,Argon charged

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Grade

Moligand™

Pureté

≥98%

Noms et identifiants

• Sourires canoniques: CC1=C(C=CC2=C1CCC3=C2C(=CC(=C3)O)C=C)O
• IUPAC Name: 5-ethenyl-1-methyl-9,10-dihydrophenanthrene-2,7-diol
• InChIKey: GEXAPRXWKRZPCK-UHFFFAOYSA-N
• INCHI: 1S/C17H16O2/c1-3-11-8-13(18)9-12-4-5-14-10(2)16(19)7-6-15(14)17(11)12/h3,6-9,18-19H,1,4-5H2,2H3
• Isomères SMILES: CC1=C(C=CC2=C1CCC3=C2C(=CC(=C3)O)C=C)O
• CAS alternatif: 73166-28-6
• PubChem CID: 100801
• Numéro NSC: 371300
• Termes d'entrée MeSH: effusol
• Poids moléculaire: 252.31

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenanthrenes and derivatives
      • Subclass Hydrophenanthrenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenanthrenes and derivatives
• Subclass: Hydrophenanthrenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Hydrophenanthrenes
• Alternative Parents: Naphthalenes Styrenes 1-hydroxy-2-unsubstituted benzenoids Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Hydrophenanthrene - Naphthalene - Styrene - 1-hydroxy-2-unsubstituted benzenoid - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as hydrophenanthrenes. These are a phenanthrene derivative where at least one ring CC bond is substituted by hydrogenation.
• 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

Cibles associées (humaines)

ESR2 Tclin Estrogen receptor beta (1 Activities)

Discover Target: ESR2

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

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ESR2 Tclin Estrogen receptor beta (9272 Activities)

Discover Target: ESR2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLC22A8 Tclin Solute carrier family 22 member 8 (241 Activities)

Discover Target: SLC22A8

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Cibles associées (non humaines)

Staphylococcus aureus (210822 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mycobacterium tuberculosis (203094 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mus musculus (284745 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

RAW264.7 (28094 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Slc22a6 Solute carrier family 22 member 6 (141 Activities)

Discover Target: Slc22a6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rmlD dTDP-4-dehydrorhamnose reductase (49 Activities)

Discover Target: rmlD

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mécanismes d'action

Propriétés chimiques et physiques

• Sensibilité: light & Moisture sensitive
• Poids moléculaire: 252.310 g/mol
• XLogP3: 4.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 252.115 Da
• Monoisotopic Mass: 252.115 Da
• Topological Polar Surface Area: 40.500 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 340.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1