Found 1 result

Search term: YCTQSBSHNMQDKH (Found by InChIKey (skeleton match))

ChemSpider 2D Image | (6beta,8xi,9xi,12alpha,13alpha,14beta,20Z)-4-Ethyl-3,12-dihydroxy-4,14-dimethyl-18-norcholesta-20(22),24-dien-6-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside | C42H70O12

(6β,8ξ,9ξ,12α,13α,14β,20Z)-4-Ethyl-3,12-dihydroxy-4,14-dimethyl-18-norcholesta-20(22),24-dien-6-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside

  • Molecular FormulaC42H70O12
  • Average mass766.998 Da
  • Monoisotopic mass766.486755 Da
  • ChemSpider ID4943676
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 16 of 21 defined stereocentres


More details:






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

(6β,8ξ,9ξ,12α,13α,14β,20Z)-4-Ethyl-3,12-dihydroxy-4,14-dimethyl-18-norcholesta-20(22),24-dien-6-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside [ACD/IUPAC Name]
(6β,8ξ,9ξ,12α,13α,14β,20Z)-4-Ethyl-3,12-dihydroxy-4,14-dimethyl-18-norcholesta-20(22),24-dien-6-yl-2-O-(6-desoxy-α-L-mannopyranosyl)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
2-O-(6-Désoxy-α-L-mannopyranosyl)-β-D-glucopyranoside de (6β,8ξ,9ξ,12α,13α,14β,20Z)-4-éthyl-3,12-dihydroxy-4,14-diméthyl-18-norcholesta-20(22),24-dién-6-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (6β,8ξ,9ξ,12α,13α,14β,17β)-17-[(1Z)-1,5-dimethyl-1,4-hexadien-1-yl]-4-ethyl-3,12-dihydroxy-4,10,14-trimethylgonan-6-yl 2-O-(6-deoxy-α-L-mannopyranosyl)- [ACD/Index Name]
126223-28-7 [RN]
3,6,12-Trihydroxydammar-10(22),24-diene-O-rhamnosyl-(1-2)-glucopyranoside
Ginsenoside RG4

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

Density: 1.3±0.1 g/cm3
Boiling Point: 860.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 142.1±6.0 kJ/mol
Flash Point: 474.0±34.3 °C
Index of Refraction: 1.591
Molar Refractivity: 202.5±0.4 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 4
ACD/LogP: 8.37
ACD/LogD (pH 5.5): 5.16
ACD/BCF (pH 5.5): 4923.93
ACD/KOC (pH 5.5): 15295.00
ACD/LogD (pH 7.4): 5.16
ACD/BCF (pH 7.4): 4923.88
ACD/KOC (pH 7.4): 15294.83
Polar Surface Area: 199 Å2
Polarizability: 80.3±0.5 10-24cm3
Surface Tension: 60.8±5.0 dyne/cm
Molar Volume: 599.1±5.0 cm3

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