Methylnissolin - ≥99% , CAS No.73340-41-7

CAS: 73340-41-7 Cat. No.: M650619 Molecular Weight: 300.3 PubChem CID: 14077830

GRADE & PURITY ≥99%

Synonyms

(6ar,11ar)-9,10-dimethoxy6a,11a-dihydro-6h-benzofurano [3,2-c]chromen-3-ol | C17416 | (6aR,11aR)-9,10-dimethoxy-6a,11a-dihydro-6H-benzofuro[3,2-c]chromen-3-ol | HY-N2484 | XM173149 | CHEBI:81072 | Q27155029 | MS-24325 | Methylnissolin | DTXSID901248967 |

Storage

Protected from light,Store at -80°C

Shipped In

Dry ice packs + Cold packs

Overview

Methylnissolin (Astrapterocarpan), isolated from Astragalus membranaceus , inhibits platelet-derived growth factor (PDGF) -BB-induced cell proliferation with an IC 50 of 10 μM. Methylnissolin inhibits PDGF-BB-induced phosphorylation of extracellular signal-regulated kinase 1/2 (ERIC1/2) mitogen-activated protein (MAP) kinase. Methylnissolin inhibits PDGF-BB-induced vascular smooth muscle cell proliferation by inhibition of the ERK1/2 MAP kinase cascade

Form:Solid

IC50& Target:PDGFR 10 μM (IC 50 ) ERK1 ERK2

Specifications

Synonyms

(6ar, 11ar)-9, 10-dimethoxy6a, 11a-dihydro-6h-benzofurano [3, 2-c]chromen-3-ol | C17416 | (6aR, 11aR)-9, 10-dimethoxy-6a, 11a-dihydro-6H-benzofuro[3, 2-c]chromen-3-ol | HY-N2484 | XM173149 | CHEBI:81072 | Q27155029 | MS-24325 | Methylnissolin | DTXSID901248967 |

Specifications & Purity

≥99%

Biochemical and Physiological Mechanisms

Methylnissolin (Astrapterocarpan), isolated from Astragalus membranaceus , inhibits platelet-derived growth factor (PDGF) -BB-induced cell proliferation with an IC 50 of 10 μM. Methylnissolin inhibits PDGF-BB-induced phosphorylation of extracellular signa

Storage

Protected from light, Store at -80°C

Shipped In

Dry ice packs + Cold packs

This product requires cold chain shipping. Ground and other economy services are not available.

Action Type

INHIBITOR

Purity

≥99%

Names and Identifiers

• Canonical Smiles: COC1=C(C2=C(C=C1)C3COC4=C(C3O2)C=CC(=C4)O)OC
• IUPAC Name: (6aR,11aR)-9,10-dimethoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-ol
• InChIKey: UOVGCLXUTLXAEC-WFASDCNBSA-N
• INCHI: 1S/C17H16O5/c1-19-13-6-5-10-12-8-21-14-7-9(18)3-4-11(14)15(12)22-16(10)17(13)20-2/h3-7,12,15,18H,8H2,1-2H3/t12-,15-/m0/s1
• Isomeric SMILES: COC1=C(C2=C(C=C1)[C@@H]3COC4=C([C@@H]3O2)C=CC(=C4)O)OC
• Alternate CAS: 73340-41-7
• PubChem CID: 14077830
• Molecular Weight: 300.3

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Phenylpropanoids and polyketides
    • Class Isoflavonoids
      • Subclass Furanoisoflavonoids

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• Class: Isoflavonoids
• Subclass: Furanoisoflavonoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Pterocarpans
• Alternative Parents: Isoflavanols 1-benzopyrans Coumarans Benzofurans Anisoles Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Oxacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pterocarpan - Isoflavanol - Isoflavan - Chromane - 1-benzopyran - Benzopyran - Coumaran - Benzofuran - Anisole - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Benzenoid - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as pterocarpans. These are benzo-pyrano-furano-benzene compounds, containing the 6H-[1]benzofuro[3,2-c]chromene skeleton. They are derivatives of isoflavonoids.
• External Descriptors: pterocarpans

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

Chemical and Physical Properties

• Solubility: DMSO : 50 mg/mL (166.49 mM; Need ultrasonic)
• Molecular Weight: 300.300 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 300.1 Da
• Monoisotopic Mass: 300.1 Da
• Topological Polar Surface Area: 57.200 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 403.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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