Tangshenoside I - ≥97% , CAS No.117278-74-7

CAS: 117278-74-7 Cat. No.: T646800 Formula: C₂₉H₄₂O₁₈ Molecular Weight: 678.63 PubChem CID: 6441191

GRADE & PURITY ≥97%

Synonyms

Tangshenoside I | 5-[(E)-3-[3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoxy]-3-methyl-5-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentanoic acid | UNII-9WKT543Z4X | beta-D-G

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Tangshenoside I, isolated from the roots of Codonopsis lanceolata , exhibits weak α-glucosidase inhibitory activities in vitro with an IC 50 of 1.4 mM.

Form:Solid

Specifications

Synonyms

Tangshenoside I | 5-[(E)-3-[3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoxy]-3-methyl-5-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentanoic acid | UNII-9WKT543Z4X | beta-D-G

Specifications & Purity

≥97%

Biochemical and Physiological Mechanisms

Tangshenoside I, isolated from the roots of Codonopsis lanceolata , exhibits weak α-glucosidase inhibitory activities in vitro with an IC 50 of 1.4 mM.

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

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

Action Type

INHIBITOR

Purity

≥97%

Names and Identifiers

Canonical Smiles

CC(CC(=O)O)(CC(=O)OCC=CC1=CC(=C(C(=C1)OC)OC2C(C(C(C(O2)CO)O)O)O)OC)OC3C(C(C(C(O3)CO)O)O)O

IUPAC Name

5-[(E)-3-[3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoxy]-3-methyl-5-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentanoic acid

InChIKey

ABKPQICIFGNRAA-YCRPTBBLSA-N

INCHI

1S/C29H42O18/c1-29(9-18(32)33,47-28-25(40)23(38)21(36)17(12-31)45-28)10-19(34)43-6-4-5-13-7-14(41-2)26(15(8-13)42-3)46-27-24(39)22(37)20(35)16(11-30)44-27/h4-5,7-8,16-17,20-25,27-28,30-31,35-40H,6,9-12H2,1-3H3,(H,32,33)/b5-4+/t16-,17-,20-,21-,22+,23+,24-,25-,27+,28+,29?/m1/s1

Isomeric SMILES

CC(CC(=O)O)(CC(=O)OC/C=C/C1=CC(=C(C(=C1)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O

Alternate CAS

117278-74-7

PubChem CID

6441191

MeSH Entry Terms

tangshenoside I

Molecular Weight

678.63

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Glycosyl compounds
          • Level6 Phenolic glycosides

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Glycosyl compounds
• Direct Parent: Phenolic glycosides
• Alternative Parents: Fatty acyl glycosides of mono- and disaccharides O-glycosyl compounds Dimethoxybenzenes Styrenes Anisoles Phenoxy compounds Sugar acids and derivatives Alkyl aryl ethers Fatty acid esters Dicarboxylic acids and derivatives Oxanes Monosaccharides Secondary alcohols Carboxylic acid esters Oxacyclic compounds Polyols Acetals Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Primary alcohols Organic oxides
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenolic glycoside - Fatty acyl glycoside of mono- or disaccharide - Fatty acyl glycoside - O-glycosyl compound - M-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Styrene - Alkyl aryl ether - Sugar acid - Fatty acid ester - Benzenoid - Dicarboxylic acid or derivatives - Fatty acyl - Oxane - Monocyclic benzene moiety - Monosaccharide - Carboxylic acid ester - Secondary alcohol - Ether - Organoheterocyclic compound - Carboxylic acid - Acetal - Carboxylic acid derivative - Oxacycle - Polyol - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Primary alcohol - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose.
• 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

Chemical and Physical Properties

• Solubility: H2O : 25 mg/mL (36.84 mM; Need ultrasonic)