Found 57 results

Search term: MF = 'C_{47}H_{76}O_{16}'
ChemSpider 2D Image | 3-{[6-Deoxyhexopyranosyl-(1->2)hexopyranosyl-(1->2)pentopyranosyl]oxy}olean-12-en-28-oic acid | C47H76O16

3-{[6-Deoxyhexopyranosyl-(1->2)hexopyranosyl-(1->2)pentopyranosyl]oxy}olean-12-en-28-oic acid

  • Molecular FormulaC47H76O16
  • Average mass897.097 Da
  • Monoisotopic mass896.513306 Da
  • ChemSpider ID304445

More details:

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

3-{[6-Deoxyhexopyranosyl-(1->2)hexopyranosyl-(1->2)pentopyranosyl]oxy}olean-12-en-28-oic acid [ACD/IUPAC Name]
3-{[6-Desoxyhexopyranosyl-(1->2)hexopyranosyl-(1->2)pentopyranosyl]oxy}olean-12-en-28-säure [German] [ACD/IUPAC Name]
Acide 3-{[6-désoxyhexopyranosyl-(1->2)hexopyranosyl-(1->2)pentopyranosyl]oxy}oléan-12-én-28-oïque [French] [ACD/IUPAC Name]
Olean-12-en-28-oic acid, 3-[[O--6-deoxyhexopyranosyl-(1->2)-O-hexopyranosyl-(1->2)pentopyranosyl]oxy]- [ACD/Index Name]
10-[3-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
89412-79-3 [RN]
Isolate from Anemone raddeana regel
Raddeanin A

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

NSC382873 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 967.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 159.7±6.0 kJ/mol
Flash Point: 276.2±27.8 °C
Index of Refraction: 1.610
Molar Refractivity: 227.1±0.4 cm3
#H bond acceptors: 16
#H bond donors: 9
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 4
ACD/LogP: 10.11
ACD/LogD (pH 5.5): 5.86
ACD/BCF (pH 5.5): 10123.81
ACD/KOC (pH 5.5): 14040.06
ACD/LogD (pH 7.4): 4.06
ACD/BCF (pH 7.4): 159.49
ACD/KOC (pH 7.4): 221.19
Polar Surface Area: 255 Å2
Polarizability: 90.0±0.5 10-24cm3
Surface Tension: 68.3±5.0 dyne/cm
Molar Volume: 654.9±5.0 cm3

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