ChemSpider 2D Image | 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-chromeniumyl 2-O-beta-D-gulopyranosyl-6-O-[(2Z)-3-(4-hydroxyphenyl)-2-propenoyl]-beta-D-gulopyranoside | C36H37O18

2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-chromeniumyl 2-O-β-D-gulopyranosyl-6-O-[(2Z)-3-(4-hydroxyphenyl)-2-propenoyl]-β-D-gulopyranoside

  • Molecular FormulaC36H37O18
  • Average mass757.668 Da
  • Monoisotopic mass757.197449 Da
  • ChemSpider ID115269039

  • Charge - Charge

    defined stereocentres - 10 of 10 defined stereocentres

More details:

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

2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-chromeniumyl 2-O-β-D-gulopyranosyl-6-O-[(2Z)-3-(4-hydroxyphenyl)-2-propenoyl]-β-D-gulopyranoside [ACD/IUPAC Name]
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-chromeniumyl-2-O-β-D-gulopyranosyl-6-O-[(2Z)-3-(4-hydroxyphenyl)-2-propenoyl]-β-D-gulopyranosid [German] [ACD/IUPAC Name]
2-O-β-D-Gulopyranosyl-6-O-[(2Z)-3-(4-hydroxyphényl)-2-propenoyl]-β-D-gulopyranoside de 2-(3,4-dihydroxyphényl)-5,7-dihydroxy-3-chroméniumyle [French] [ACD/IUPAC Name]
β-D-Gulopyranoside, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1-benzopyrylium-3-yl 2-O-β-D-gulopyranosyl-6-O-[(2Z)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]- [ACD/Index Name]
Cyanidin 3-(6''-(Z)-p-coumarylsophoroside)

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 18
#H bond donors: 11
#Freely Rotating Bonds: 11
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 299 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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