Paeoniflorgenin - ≥90% , CAS No.697300-41-7

CAS: 697300-41-7 Cat. No.: P650826 Molecular Weight: 318.32 PubChem CID: 154925992

GRADE & PURITY ≥90%

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Overview

Paeoniflorgenin is a deglucosylated metabolite of Paeoniflorin.

Form:Solid

Specifications

Specifications & Purity

≥90%

Biochemical and Physiological Mechanisms

Paeoniflorgenin is a deglucosylated metabolite of Paeoniflorin.

Storage

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.

Purity

≥90%

Names and Identifiers

• Canonical Smiles: CC12CC3(C4CC1(C4(C(O2)O3)COC(=O)C5=CC=CC=C5)O)O
• IUPAC Name: [(2S,3S,5R,6R,8S)-3,6-dihydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-2-yl]methyl benzoate
• InChIKey: GWQHMWOOQLVRLG-BZEIYFPWSA-N
• INCHI: 1S/C17H18O6/c1-14-8-16(19)11-7-17(14,20)15(11,13(22-14)23-16)9-21-12(18)10-5-3-2-4-6-10/h2-6,11,13,19-20H,7-9H2,1H3/t11-,13?,14+,15+,16-,17-/m1/s1
• PubChem CID: 154925992
• Molecular Weight: 318.32

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Prenol lipids
• Subclass: Monoterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Bicyclic monoterpenoids
• Alternative Parents: Benzoic acid esters Aromatic monoterpenoids Furofurans Benzoyl derivatives Oxepanes Monosaccharides 1,3-dioxanes Tetrahydrofurans Tertiary alcohols Hemiacetals Cyclic alcohols and derivatives Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pinane monoterpenoid - Benzoate ester - Aromatic monoterpenoid - Benzoic acid or derivatives - Furofuran - Benzoyl - Oxepane - Benzenoid - Monosaccharide - Monocyclic benzene moiety - Meta-dioxane - Tetrahydrofuran - Tertiary alcohol - Cyclic alcohol - Hemiacetal - Cyclobutanol - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aromatic heteropolycyclic compound
• Description: 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