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ChemSpider 2D Image | Stigmast-5-en-3-yl hexopyranoside | C35H60O6

Stigmast-5-en-3-yl hexopyranoside

  • Molecular FormulaC35H60O6
  • Average mass576.847 Da
  • Monoisotopic mass576.438965 Da
  • ChemSpider ID261366

More details:





Date of deprecation: 13:53, Mar 26, 2015
Reason for deprecation: Deprecate record: 14 undefined sterocentres

If you believe this record was deprecated in error, please use the Comment on this record button to contact the ChemSpider team.

Common reasons for deprecation are:
  • Chemically impossible structures (eg. incorrect valence atoms)
  • Lack of any linking data sources
  • Poor depiction of a structure that is already in ChemSpider

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

Hexopyranoside de stigmast-5-én-3-yle [French] [ACD/IUPAC Name]
Hexopyranoside, stigmast-5-en-3-yl [ACD/Index Name]
Stigmast-5-en-3-yl hexopyranoside [ACD/IUPAC Name]
Stigmast-5-en-3-ylhexopyranosid [German] [ACD/IUPAC Name]
2-[17-(4-Ethyl-1,5-dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yloxy]-6-hydroxymethyl-tetrahydro-pyran-3,4,5-triol
BSSG
Daucosterol [Wiki]

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

AW 10 [DBID]
NCI60_001282 [DBID]
NSC165962 [DBID]
WA 184 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 673.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.2±6.0 kJ/mol
Flash Point: 361.2±31.5 °C
Index of Refraction: 1.554
Molar Refractivity: 162.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.78
ACD/LogD (pH 5.5): 7.18
ACD/BCF (pH 5.5): 168582.45
ACD/KOC (pH 5.5): 191835.48
ACD/LogD (pH 7.4): 7.18
ACD/BCF (pH 7.4): 168581.34
ACD/KOC (pH 7.4): 191834.22
Polar Surface Area: 99 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 48.6±5.0 dyne/cm
Molar Volume: 508.7±5.0 cm3

Click to predict properties on the Chemicalize site






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