(3S)-3-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one

Base Information

• Chemical Name: (3S)-3-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one
• CAS No.: 35943-38-5
• Molecular Formula: C21H30O8
• Molecular Weight: 410.46
• Wikidata: Q110199646
• Mol file: 35943-38-5.mol

Synonyms:(3S)-3-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one;(3S)-Pteroside D;3-Hydroxy-2,2,5,7-tetramethyl-6-[2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one;AKOS032948215;B0005-190280

Chemical Property of (3S)-3-hydroxy-2,2,5,7-tetramethyl-6-[2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-3H-inden-1-one

Chemical Property:

• Vapor Pressure: 4.77E-18mmHg at 25°C
• Boiling Point: 655°C at 760 mmHg
• PKA: 12.93±0.70(Predicted)
• Flash Point: 227.9°C
• PSA: 136.68000
• Density: 1.38g/cm³
• LogP: -0.08170
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 410.19406791
• Heavy Atom Count: 29
• Complexity: 595

Purity/Quality:

Analysis control,HPLC≥98% ^*data from raw suppliers

PterosideD 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C(=C1CCOC3C(C(C(C(O3)CO)O)O)O)C)C(=O)C(C2O)(C)C