Hyperforin - Moligand™, ≥98% , Agonist of Pregnane X receptor;Activator of TRPC6, CAS No.11079-53-1, Agonist of Pregnane X receptor;Activator of TRPC6

CAS: 11079-53-1 Cat. No.: H275963 분자식: C₃₅H₅₂O₄ 분자량: 536.78

GRADE & PURITY Moligand™, ≥98%

Synonyms

(+)-Hyperforin | Q412742 | UNII-RM741E34FP | HYPERFORIN [HSDB] | Spectrum5_002025 | GTPL2764 | HYPERFORIN (CONSTITUENT OF ST. JOHN'S WORT) [DSC] | C07608 | HSDB 7646 | hyperforin | DB01892 | IWBJJCOKGLUQIZ-HQKKAZOISA-N | BICYCLO(3.3.1)NON-3-ENE-2,9-DIONE,

Storage

Protected from light,Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

개요

Store at -20°C. Store In the Dark. Store under desiccating conditions. This product is air and light sensitive and impurities can occur as a result of air oxidation or due to metabolism by microbes.

Specifications

동의어

(+)-Hyperforin | Q412742 | UNII-RM741E34FP | HYPERFORIN [HSDB] | Spectrum5_002025 | GTPL2764 | HYPERFORIN (CONSTITUENT OF ST. JOHN'S WORT) [DSC] | C07608 | HSDB 7646 | hyperforin | DB01892 | IWBJJCOKGLUQIZ-HQKKAZOISA-N | BICYCLO(3.3.1)NON-3-ENE-2,9-DIONE,

사양 및 순도

Moligand™, ≥98%

생화학 및 생리적 메커니즘

'Biological description': "Key constituent of St. John's wort. Various pharmacological effects. Antibacterial, antimalarial, anti-inflammatory, anticancer, antiangiogenic and antidepressant effects. Potential anti-Alzheimer compound. Active in vitro and i

보관 조건

Protected from light,Store at -20°C,Desiccated

배송

Ice chest + Ice pads

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등급

Moligand™

작업 유형

ACTIVATOR, AGONIST

작동 메커니즘

Agonist of Pregnane X receptor;Activator of TRPC6

참고

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

순수함

≥98%

이름과 식별자

Pubchem Sid

504758751

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504758751

정식 스마일

CC(C)C(=O)C12C(=O)C(=C(C(C1=O)(CC(C2(C)CCC=C(C)C)CC=C(C)C)CC=C(C)C)O)CC=C(C)C

IUPAC Name

(1R,5R,7S,8R)-4-hydroxy-8-methyl-3,5,7-tris(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-1-(2-methylpropanoyl)bicyclo[3.3.1]non-3-ene-2,9-dione

InChIKey

KGSZHKRKHXOAMG-HQKKAZOISA-N

INCHI

1S/C35H52O4/c1-22(2)13-12-19-33(11)27(16-14-23(3)4)21-34(20-18-25(7)8)30(37)28(17-15-24(5)6)31(38)35(33,32(34)39)29(36)26(9)10/h13-15,18,26-27,37H,12,16-17,19-21H2,1-11H3/t27-,33+,34+,35-/m0/s1

이성체 SMILES

CC(C)C(=O)[C@]12C(=O)C(=C([C@](C1=O)(C[C@@H]([C@@]2(C)CCC=C(C)C)CC=C(C)C)CC=C(C)C)O)CC=C(C)C

WGK 독일

2

대체 CAS

238074-03-8

분자량

536.78

Reaxy-Rn

24710083

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=24710083&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • 분류 Prenol lipids
      • Subclass Monoterpenoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 분류: Prenol lipids
• Subclass: Monoterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Bicyclic monoterpenoids
• Alternative Parents: Cyclohexenones Vinylogous acids Enols Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Bicyclic monoterpenoid - Cyclohexenone - Vinylogous acid - Ketone - Enol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homopolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
• 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)

TRPC6 Tchem Short transient receptor potential channel 6 (0 Activities)

Discover Target: TRPC6

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

NR1I2 Tchem Nuclear receptor subfamily 1 group I member 2 (3 Activities)

Discover Target: NR1I2

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

화학 및 물리적 특성

• 용해성: Soluble in ethanol and in DMSO to 10 mM
• 감도: air and light sensitive
• 발화점(°F): 48.2 °F
• 발화점(°C): 9 °C
• 분자량: 536.800 g/mol
• XLogP3: 9.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 11
• Exact Mass: 536.387 Da
• Monoisotopic Mass: 536.387 Da
• Topological Polar Surface Area: 71.400 Ų
• Heavy Atom Count: 39
• Formal Charge: 0
• Complexity: 1140.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• 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