5,7-Dihydroxychromone - 10mM in DMSO , CAS No.31721-94-5

CAS: 31721-94-5 Cat. No.: D580284 분자식: C₉H₆O₄ 분자량: 178.14

GRADE & PURITY 10mM in DMSO

Synonyms

DHC | FT-0686568 | 5,7-dihydroxychromen-4-one | 5,7-Dihydroxychromone | AC-6025 | F17673 | C09001 | Q-100396 | Q27105540 | AKOS015999181 | DTXSID30185617 | SCHEMBL1860859 | 5,7-Dihydroxy-4-chromone | B7S | MS-22951 | 5,7-Dihydroxy-4H-1-benzopyran-4-one |

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifications

동의어

DHC | FT-0686568 | 5,7-dihydroxychromen-4-one | 5,7-Dihydroxychromone | AC-6025 | F17673 | C09001 | Q-100396 | Q27105540 | AKOS015999181 | DTXSID30185617 | SCHEMBL1860859 | 5,7-Dihydroxy-4-chromone | B7S | MS-22951 | 5,7-Dihydroxy-4H-1-benzopyran-4-one |

사양 및 순도

10mM in DMSO

생화학 및 생리적 메커니즘

5,7-Dihydroxychromone, the extract of Cudrania tricuspidata, activates Nrf2/ARE signal and exerts neuroprotective effects against 6-hydroxydopamine (6-OHDA)-induced oxidative stress and apoptosis. 5,7-Dihydroxychromone inhibits the expression of activated

보관 조건

Store at -80°C

배송

Dry ice packs + Cold packs

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작업 유형

ACTIVATOR

이름과 식별자

• Pubchem Sid: 528761178
• 정식 스마일: C1=COC2=CC(=CC(=C2C1=O)O)O
• IUPAC Name: 5,7-dihydroxychromen-4-one
• InChIKey: NYCXYKOXLNBYID-UHFFFAOYSA-N
• INCHI: 1S/C9H6O4/c10-5-3-7(12)9-6(11)1-2-13-8(9)4-5/h1-4,10,12H
• 이성체 SMILES: C1=COC2=CC(=CC(=C2C1=O)O)O
• 분자량: 178.14
• Reaxy-Rn: 154579
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=154579&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 분류 Benzopyrans
      • Subclass 1-benzopyrans

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: Benzopyrans
• Subclass: 1-benzopyrans
• Intermediate Tree Nodes: Not available
• Direct Parent: Chromones
• Alternative Parents: Pyranones and derivatives 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Vinylogous acids Heteroaromatic compounds Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Chromone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Benzenoid - Pyran - Heteroaromatic compound - Vinylogous acid - Oxacycle - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as chromones. These are compounds containing a benzopyran-4-one moiety.
• External Descriptors: chromones

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

작용 메커니즘

화학 및 물리적 특성

• 용해성: insoluble in H2O; ≥5.41 mg/mL in EtOH with gentle warming; ≥7.05 mg/mL in DMSO
• 감도: Light sensitive
• 분자량: 178.140 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 178.027 Da
• Monoisotopic Mass: 178.027 Da
• Topological Polar Surface Area: 66.800 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 248.000
• 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

참고 문헌

1. Wang Baolin, Wang Qinqin, Yuan Renyikun, Yang Shilin, Lu Meilin, Yuan Fuhong, Dong Zhidan, Mo Menghuan, Pan Qiming, Gao Hongwei.  (2023)  Prenylated chromones and flavonoids isolated from the roots of Flemingia macrophylla and their anti-lung cancer activity.  Chinese Medicine,  18  (1): (1-14).  [PMID:37996917] [10.1186/s13020-023-00860-3]