Scutellarioside II

Base Information

• Chemical Name: Scutellarioside II
• CAS No.: 58286-53-6
• Molecular Formula: C24H28O12
• Molecular Weight: 508.4719
• DSSTox Substance ID: DTXSID401346760
• Nikkaji Number: J936.402A
• Wikidata: Q104402224

Synonyms:Scutellarioside II;58286-53-6;MEGxp0_000553;10-0-(E)-p-coumaroylcatalpol;ACon1_000811;CHEBI:167794;DTXSID401346760;NCGC00169336-01;NCGC00169336-02;BRD-K25058470-001-01-3;[(1S,2S,4S,5S,6R,10S)-5-hydroxy-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate;beta-D-Glucopyranoside, (1aS,1bS,2S,5aR,6S,6aS)-1a,1b,2,5a,6,6a-hexahydro-6-hydroxy-1a-((((2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl)oxy)methyl)oxireno(4,5)cyclopenta(1,2-c)pyran-2-yl

Chemical Property of Scutellarioside II

Chemical Property:

• Vapor Pressure: 2.54E-28mmHg at 25°C
• Boiling Point: 818.2°Cat760mmHg
• Flash Point: 280.4°C
• Density: 1.62g/cm³
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 8
• Exact Mass: 508.15807632
• Heavy Atom Count: 36
• Complexity: 856

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=COC(C2C1C(C3C2(O3)COC(=O)C=CC4=CC=C(C=C4)O)O)OC5C(C(C(C(O5)CO)O)O)O
• Isomeric SMILES: C1=CO[C@H]([C@H]2[C@@H]1[C@@H]([C@H]3[C@@]2(O3)COC(=O)/C=C/C4=CC=C(C=C4)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O

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