Rubiadinprimeveroside

Base Information

• Chemical Name: Rubiadinprimeveroside
• CAS No.: 26388-47-6
• Molecular Formula: C26H28 O13
• Molecular Weight: 548.501
• DSSTox Substance ID: DTXSID90949277
• Nikkaji Number: J468.258K
• Mol file: 26388-47-6.mol

Synonyms:Rubiadinprimeveroside;Rubiadin-primveroside;BRN 0071982;26388-47-6;4-17-00-03463 (Beilstein Handbook Reference);1-Hydroxy-2-methyl-3-((6-O-beta,D-xylopyranosyl-beta-D-glucopyranosyl)oxy)-9,10-anthracenedione;beta-D-4-Hydroxy-3-methyl-2-anthraquinonyl 6-O-beta-D-xylopyranosylglucopyranoside;Glucopyranoside, 4-hydroxy-3-methyl-2-anthraquinonyl 6-O-beta-D-xylopyranosyl-, beta-D-;9,10-Anthracenedione, 1-hydroxy-2-methyl-3-((6-O-beta,D-xylopyranosyl-beta-D-glucopyranosyl)oxy)-;C26H28O13;DTXSID90949277;LS-71544;4-Hydroxy-3-methyl-9,10-dioxo-9,10-dihydroanthracen-2-yl 6-O-pentopyranosylhexopyranoside

Chemical Property of Rubiadinprimeveroside

Chemical Property:

• Vapor Pressure: 2.19E-34mmHg at 25°C
• Boiling Point: 894.5°Cat760mmHg
• Flash Point: 301.8°C
• PSA: 212.67000
• Density: 1.69g/cm³
• LogP: -1.88200
• XLogP3: -0.8
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 5
• Exact Mass: 548.15299094
• Heavy Atom Count: 39
• Complexity: 901

Purity/Quality:

99%, ^*data from raw suppliers

RUBIADINPRIMVEROSIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)OC4C(C(C(C(O4)COC5C(C(C(CO5)O)O)O)O)O)O
• Isomeric SMILES: CC1=C(C=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5[C@@H]([C@H]([C@@H](CO5)O)O)O)O)O)O