Schizandrin C - Moligand™, 10mM in DMSO , CAS No.61301-33-5

CAS: 61301-33-5 Cat. No.: S425077 分子式: C₂₂H₂₄O₆ 分子量: 384.42 EC番号: 809-293-7

GRADE & PURITY Moligand™, 10mM in DMSO

Synonyms

schisandrin C|61301-33-5|Wuweizisu C|Schizandrin-C;Wuweizisu-C|NSC609258|schisandrinC|66138-32-7|Schisandrin dervative|Schisandrin derivative|R-(+)-Wuweizisu C|SCHEMBL12280310|DTXSID101317497|Schisandrin C, >=98% (HPLC)|MFCD00272170|CCG-268455|NSC-609258|

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

概要

Schisandrin C is a lignan found in the fruit of Schisandra chinensis.

Specifications

同義語

schisandrin C | 61301-33-5 | Wuweizisu C | Schizandrin-C;Wuweizisu-C | NSC609258 | schisandrinC | 66138-32-7 | Schisandrin dervative | Schisandrin derivative | R-(+)-Wuweizisu C | SCHEMBL12280310 | DTXSID101317497 | Schisandrin C, >=98% (HPLC) | MFCD00272170 | CCG-268455 | NSC-609258 |

仕様と純度

Moligand™, 10mM in DMSO

生化学的・生理学的メカニズム

Schisandrin C has anti-inflammatory effects and has been shown to reduce nitric oxide (NO) production.

保管条件

Store at -80°C

入荷

Dry ice packs + Cold packs

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

等級

Moligand™

名前と識別子

パブケム・シド

528769788

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/528769788

カノニカル・スマイル

CC1CC2=CC3=C(C(=C2C4=C(C5=C(C=C4CC1C)OCO5)OC)OC)OCO3

IUPAC Name

3,22-dimethoxy-12,13-dimethyl-5,7,18,20-tetraoxapentacyclo[13.7.0.02,10.04,8.017,21]docosa-1(22),2,4(8),9,15,17(21)-hexaene

InChIKey

HTBWBWWADZJXID-UHFFFAOYSA-N

INCHI

1S/C22H24O6/c1-11-5-13-7-15-19(27-9-25-15)21(23-3)17(13)18-14(6-12(11)2)8-16-20(22(18)24-4)28-10-26-16/h7-8,11-12H,5-6,9-10H2,1-4H3

異性体SMILES

CC1CC2=CC3=C(C(=C2C4=C(C5=C(C=C4CC1C)OCO5)OC)OC)OCO3

WGKドイツ

3

RTECS

GX9500000

分子量

384.42

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Phenylpropanoids and polyketides
    • 分類 Tannins
      • Subclass Hydrolyzable tannins

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• 分類: Tannins
• Subclass: Hydrolyzable tannins
• Intermediate Tree Nodes: Not available
• Direct Parent: Hydrolyzable tannins
• Alternative Parents: Dibenzocyclooctadiene lignans Benzodioxoles Anisoles Alkyl aryl ethers Oxacyclic compounds Acetals Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Hydrolyzable tannin - Dibenzocyclooctane lignan - Benzodioxole - Anisole - Alkyl aryl ether - Benzenoid - Oxacycle - Organoheterocyclic compound - Ether - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
• 説明: This compound belongs to the class of organic compounds known as hydrolyzable tannins. These are tannins with a structure characterized by either of the following models. In model 1, the structure contains galloyl units (in some cases, shikimic acid units) that are linked to diverse polyol carbohydrate-, catechin-, or triterpenoid units. In model 2, contains at least two galloyl units C-C coupled to each other, and do not contain a glycosidically linked catechin unit.
• 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

化学的性質と物理的性質

• 分子量: 384.400 g/mol
• XLogP3: 5.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 384.157 Da
• Monoisotopic Mass: 384.157 Da
• Topological Polar Surface Area: 55.400 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 509.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1