Found 15 results

Search term: MF = 'C_{37}H_{62}O_{8}'
ChemSpider 2D Image | (1S,4S,7S,9beta,23E)-1-Hydroxy-25-methoxy-9,10,14-trimethyl-4,9-cyclo-9,10-secocholesta-5,23-dien-7-yl beta-L-allopyranoside | C37H62O8

(1S,4S,7S,9β,23E)-1-Hydroxy-25-methoxy-9,10,14-trimethyl-4,9-cyclo-9,10-secocholesta-5,23-dien-7-yl β-L-allopyranoside

  • Molecular FormulaC37H62O8
  • Average mass634.883 Da
  • Monoisotopic mass634.444458 Da
  • ChemSpider ID24658223

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 14 of 14 defined stereocentres

More details:

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

(1S,4S,7S,9β,23E)-1-Hydroxy-25-methoxy-9,10,14-trimethyl-4,9-cyclo-9,10-secocholesta-5,23-dien-7-yl β-L-allopyranoside [ACD/IUPAC Name]
(1S,4S,7S,9β,23E)-1-Hydroxy-25-methoxy-9,10,14-trimethyl-4,9-cyclo-9,10-secocholesta-5,23-dien-7-yl-β-L-allopyranosid [German] [ACD/IUPAC Name]
β-L-Allopyranoside de (1S,4S,7S,9β,23E)-1-hydroxy-25-méthoxy-9,10,14-triméthyl-4,9-cyclo-9,10-sécocholesta-5,23-dién-7-yle [French] [ACD/IUPAC Name]
β-L-Allopyranoside, (3β,7β,9β,10α,17β)-3-hydroxy-17-[(1R,3E)-5-methoxy-1,5-dimethyl-3-hexen-1-yl]-4,4,9,14-tetramethylestr-5-en-7-yl [ACD/Index Name]
BALSAMINOSIDE A

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

Density: 1.2±0.1 g/cm3
Boiling Point: 718.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.2 mmHg at 25°C
Enthalpy of Vaporization: 119.9±6.0 kJ/mol
Flash Point: 388.1±32.9 °C
Index of Refraction: 1.567
Molar Refractivity: 175.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 5.71
ACD/LogD (pH 5.5): 5.21
ACD/BCF (pH 5.5): 5335.37
ACD/KOC (pH 5.5): 16199.31
ACD/LogD (pH 7.4): 5.21
ACD/BCF (pH 7.4): 5335.33
ACD/KOC (pH 7.4): 16199.20
Polar Surface Area: 129 Å2
Polarizability: 69.6±0.5 10-24cm3
Surface Tension: 51.8±5.0 dyne/cm
Molar Volume: 537.2±5.0 cm3

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