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

CAS: 73166-28-6 Cat. No.: E650958 분자식: C₁₇H₁₆O₂ 분자량: 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

개요

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

동의어

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

사양 및 순도

Moligand™, ≥98%

생화학 및 생리적 메커니즘

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

보관 조건

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

배송

Ice chest + Ice pads

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등급

Moligand™

순수함

≥98%

이름과 식별자

• 정식 스마일: 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
• 이성체 SMILES: CC1=C(C=CC2=C1CCC3=C2C(=CC(=C3)O)C=C)O
• 대체 CAS: 73166-28-6
• PubChem CID: 100801
• NSC 번호: 371300
• MeSH 용어: effusol
• 분자량: 252.31

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: 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
• 설명: 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

관련 대상(인간)

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

관련 대상(비인간)

Staphylococcus aureus (210822 Activities)

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Mycobacterium tuberculosis (203094 Activities)

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Mus musculus (284745 Activities)

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

RAW264.7 (28094 Activities)

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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

작용 메커니즘

화학 및 물리적 특성

• 감도: light & Moisture sensitive
• 분자량: 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