ChemSpider 2D Image | 5-Hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-D-glucopyranoside | C29H34O15

5-Hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(6-deoxy-α-L-mannopyranosyl)-α-D-glucopyranoside

  • Molecular FormulaC29H34O15
  • Average mass622.571 Da
  • Monoisotopic mass622.189758 Da
  • ChemSpider ID5140798
  • defined stereocentres - 10 of 10 defined stereocentres


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

134-33-8 [RN]
4H-1-Benzopyran-4-one, 7-[[6-O-(6-deoxy-α-L-mannopyranosyl)-α-D-glucopyranosyl]oxy]-5-hydroxy-6-methoxy-2-(4-methoxyphenyl)- [ACD/Index Name]
5-Hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(6-deoxy-α-L-mannopyranosyl)-α-D-glucopyranoside [ACD/IUPAC Name]
5-Hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl-6-O-(6-desoxy-α-L-mannopyranosyl)-α-D-glucopyranosid [German] [ACD/IUPAC Name]
5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-7-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxymethyl]-2-oxanyl]oxy]-1-benzopyran-4-one
6-O-(6-Désoxy-α-L-mannopyranosyl)-α-D-glucopyranoside de 5-hydroxy-6-méthoxy-2-(4-méthoxyphényl)-4-oxo-4H-chromén-7-yle [French] [ACD/IUPAC Name]
[28978-02-1]
1434126-45-0 [RN]
28978-02-1 [RN]
4H-1-Benzopyran-4-one,7-[[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

DivK1c_006394 [DBID]
KBio1_001338 [DBID]
KBio2_001009 [DBID]
KBio2_003577 [DBID]
KBio2_006145 [DBID]
KBio3_001131 [DBID]
KBioGR_002097 [DBID]
KBioSS_001009 [DBID]
SDCCGMLS-0066414.P001 [DBID]
SPBio_000199 [DBID]
More...
  • Miscellaneous
    • Chemical Class:

      flavone glycoside Microsource [00200115]
    • Drug Status:

      undetermined activity Microsource [00200115]
    • Compound Source:

      Cirsium and Linaria spp, Kickxia elatine, Duranta plumieri Microsource [00200115]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 896.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 136.5±3.0 kJ/mol
Flash Point: 292.4±27.8 °C
Index of Refraction: 1.683
Molar Refractivity: 146.5±0.4 cm3
#H bond acceptors: 15
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 1.71
ACD/LogD (pH 5.5): 0.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 21.33
ACD/LogD (pH 7.4): -1.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.25
Polar Surface Area: 223 Å2
Polarizability: 58.1±0.5 10-24cm3
Surface Tension: 90.1±5.0 dyne/cm
Molar Volume: 386.6±5.0 cm3

Click to predict properties on the Chemicalize site






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