ChemSpider 2D Image | 5'-O-[(S)-{[(R)-({(2R,3Z)-4-[(6R)-2-Amino-4-oxo-3,4,6,7-tetrahydro-6-pteridinyl]-2-hydroxy-3,4-disulfanyl-3-buten-1-yl}oxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]guanosine | C20H26N10O13P2S2

5'-O-[(S)-{[(R)-({(2R,3Z)-4-[(6R)-2-Amino-4-oxo-3,4,6,7-tetrahydro-6-pteridinyl]-2-hydroxy-3,4-disulfanyl-3-buten-1-yl}oxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]guanosine

  • Molecular FormulaC20H26N10O13P2S2
  • Average mass740.557 Da
  • Monoisotopic mass740.059753 Da
  • ChemSpider ID61709804

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

2,3-Dihydroguanosine, 5'-O-[[[[[(2R,3Z)-4-[(6R)-1,2,3,4,6,7-hexahydro-2-imino-4-oxo-6-pteridinyl]-2-hydroxy-3,4-dimercapto-3-buten-1-yl]oxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]- [ACD/Index Name]
5'-O-(Hydroxy{[hydroxy({(2R,3Z)-2-hydroxy-4-[(6R)-2-imino-4-oxo-1,2,3,4,6,7-hexahydro-6-pteridinyl]-3,4-disulfanyl-3-buten-1-yl}oxy)phosphoryl]oxy}phosphoryl)-2,3-dihydroguanosin [German] [ACD/IUPAC Name]
5'-O-(Hydroxy{[hydroxy({(2R,3Z)-2-hydroxy-4-[(6R)-2-imino-4-oxo-1,2,3,4,6,7-hexahydro-6-pteridinyl]-3,4-disulfanyl-3-buten-1-yl}oxy)phosphoryl]oxy}phosphoryl)-2,3-dihydroguanosine [ACD/IUPAC Name]
5'-O-(Hydroxy{[hydroxy({(2R,3Z)-2-hydroxy-4-[(6R)-2-imino-4-oxo-1,2,3,4,6,7-hexahydro-6-ptéridinyl]-3,4-disulfanyl-3-butén-1-yl}oxy)phosphoryl]oxy}phosphoryl)-2,3-dihydroguanosine [French] [ACD/IUPAC Name]
5'-O-[(S)-{[(R)-({(2R,3Z)-4-[(6R)-2-Amino-4-oxo-3,4,6,7-tetrahydro-6-pteridinyl]-2-hydroxy-3,4-disulfanyl-3-buten-1-yl}oxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]guanosin [German] [ACD/IUPAC Name]
5'-O-[(S)-{[(R)-({(2R,3Z)-4-[(6R)-2-Amino-4-oxo-3,4,6,7-tetrahydro-6-pteridinyl]-2-hydroxy-3,4-disulfanyl-3-buten-1-yl}oxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]guanosine [ACD/IUPAC Name]
5'-O-[(S)-{[(R)-({(2R,3Z)-4-[(6R)-2-Amino-4-oxo-3,4,6,7-tétrahydro-6-ptéridinyl]-2-hydroxy-3,4-disulfanyl-3-butén-1-yl}oxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]guanosine [French] [ACD/IUPAC Name]
Guanosine, 5'-O-[(S)-[[(R)-[[(2R,3Z)-4-[(6R)-2-amino-3,4,6,7-tetrahydro-4-oxo-6-pteridinyl]-2-hydroxy-3,4-dimercapto-3-buten-1-yl]oxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]- [ACD/Index Name]
MD1
PHOSPHORIC ACID 4-(2-AMINO-4-OXO-3,4,5,6,-TETRAHYDRO-PTERIDIN-6-YL)-2-HYDROXY-3,4-DIMERCAPTO-BUT-3-EN-YL ESTER GUANYLATE ESTER

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

Density: 2.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.988
Molar Refractivity: 152.7±0.5 cm3
#H bond acceptors: 23
#H bond donors: 11
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -2.99
ACD/LogD (pH 5.5): -7.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 442 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 145.5±7.0 dyne/cm
Molar Volume: 307.9±7.0 cm3

Click to predict properties on the Chemicalize site


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