Found 198 results

Search term: MF = 'C_{33}H_{40}O_{20}'
ChemSpider 2D Image | (1S)-1,5-Anhydro-2-O-beta-D-glucopyranosyl-1-{2-[4-(beta-D-glucopyranosyloxy)phenyl]-5,7-dihydroxy-4-oxo-4H-chromen-6-yl}-D-glucitol | C33H40O20

(1S)-1,5-Anhydro-2-O-β-D-glucopyranosyl-1-{2-[4-(β-D-glucopyranosyloxy)phenyl]-5,7-dihydroxy-4-oxo-4H-chromen-6-yl}-D-glucitol

  • Molecular FormulaC33H40O20
  • Average mass756.659 Da
  • Monoisotopic mass756.211304 Da
  • ChemSpider ID114935428

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

(1S)-1,5-Anhydro-2-O-β-D-glucopyranosyl-1-{2-[4-(β-D-glucopyranosyloxy)phenyl]-5,7-dihydroxy-4-oxo-4H-chromen-6-yl}-D-glucitol [German] [ACD/IUPAC Name]
(1S)-1,5-Anhydro-2-O-β-D-glucopyranosyl-1-{2-[4-(β-D-glucopyranosyloxy)phenyl]-5,7-dihydroxy-4-oxo-4H-chromen-6-yl}-D-glucitol [ACD/IUPAC Name]
(1S)-1,5-Anhydro-2-O-β-D-glucopyranosyl-1-{2-[4-(β-D-glucopyranosyloxy)phényl]-5,7-dihydroxy-4-oxo-4H-chromén-6-yl}-D-glucitol [French] [ACD/IUPAC Name]
D-Glucitol, 1,5-anhydro-2-O-β-D-glucopyranosyl-1-C-[2-[4-(β-D-glucopyranosyloxy)phenyl]-5,7-dihydroxy-4-oxo-4H-1-benzopyran-6-yl]-, (1S)- [ACD/Index Name]
6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
63316-27-8 [RN]
Isosaponarin 2''-O-glucoside (Isovitexin-2''-4'-di-O-β-D-glucoside)
Isovitexin 4',2''-di-O-glucoside

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.8±0.1 g/cm3
Boiling Point: 1123.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 173.2±3.0 kJ/mol
Flash Point: 353.2±27.8 °C
Index of Refraction: 1.765
Molar Refractivity: 170.4±0.4 cm3
#H bond acceptors: 20
#H bond donors: 13
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -3.40
ACD/LogD (pH 5.5): -3.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 335 Å2
Polarizability: 67.5±0.5 10-24cm3
Surface Tension: 130.9±5.0 dyne/cm
Molar Volume: 412.0±5.0 cm3

Click to predict properties on the Chemicalize site


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