ChemSpider 2D Image | Methyl (6E,10S)-1-[(2S,4R,5R)-5-(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)-4-hydroxytetrahydro-2-furanyl]-3-hydroxy-10-(4-hydroxybenzyl)-5,8-dioxo-2,4-dioxa-9-aza-3-phosphaundec-6-en-11-oate 3-oxide (n
on-preferred name) | C24H27N6O12P

Methyl (6E,10S)-1-[(2S,4R,5R)-5-(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)-4-hydroxytetrahydro-2-furanyl]-3-hydroxy-10-(4-hydroxybenzyl)-5,8-dioxo-2,4-dioxa-9-aza-3-phosphaundec-6-en-11-oate 3-oxide (n on-preferred name)

  • Molecular FormulaC24H27N6O12P
  • Average mass622.478 Da
  • Monoisotopic mass622.142456 Da
  • ChemSpider ID4948046
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres


More details:






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

(6E,10S) 3-Oxyde de 1-[(2S,4R,5R)-5-(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)-4-hydroxytétrahydro-2-furanyl]-3-hydroxy-10-(4-hydroxybenzyl)-5,8-dioxo-2,4-dioxa-9-aza-3-phosphaundéc-6-én-11-oate de mét hyle [French] [ACD/IUPAC Name]
Guanosine, 3'-deoxy-5'-O-[hydroxy[[(2E)-4-[[(1S)-1-[(4-hydroxyphenyl)methyl]-2-methoxy-2-oxoethyl]amino]-1,4-dioxo-2-buten-1-yl]oxy]phosphinyl]- [ACD/Index Name]
Methyl (6E,10S)-1-[(2S,4R,5R)-5-(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)-4-hydroxytetrahydro-2-furanyl]-3-hydroxy-10-(4-hydroxybenzyl)-5,8-dioxo-2,4-dioxa-9-aza-3-phosphaundec-6-en-11-oate 3-oxide (n on-preferred name) [ACD/IUPAC Name]
Methyl-(6E,10S)-1-[(2S,4R,5R)-5-(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)-4-hydroxytetrahydro-2-furanyl]-3-hydroxy-10-(4-hydroxybenzyl)-5,8-dioxo-2,4-dioxa-9-aza-3-phosphaundec-6-en-11-oat-3-oxid (non -preferred name) [German] [ACD/IUPAC Name]
61756-21-6 [RN]
Guanosine 3',5'-cyclic phosphoric acid 2'-O-succinyl-3-tyrosine methyl ester
Guanosine, cyclic 3',5'-(hydrogen phosphate) 2'-(4-((1-((4-hydroxyphenyl)methyl)-2-methoxy-2-oxoethyl)amino)-4-oxobutanoate)
Succinyl cyclic GMP-tyrosine methyl ester
Tme-cgmp

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.721
Molar Refractivity: 140.1±0.5 cm3
#H bond acceptors: 18
#H bond donors: 7
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -1.35
ACD/LogD (pH 5.5): -5.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 273 Å2
Polarizability: 55.5±0.5 10-24cm3
Surface Tension: 83.0±7.0 dyne/cm
Molar Volume: 354.1±7.0 cm3

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