Found 1 result

Search term: C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)/C=C/C(=O)NCCNC(=O)C[N@](CCN(CC(=O)O)CC(=O)O)CC(=O)O)COP(=O)(O)O)O (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | 5-[(13E)-1-Carboxy-2,5-bis(carboxymethyl)-7,12-dioxo-2,5,8,11-tetraazatetradec-13-en-14-yl]-2'-deoxyuridine 5'-(dihydrogen phosphate) | C24H35N6O16P

5-[(13E)-1-Carboxy-2,5-bis(carboxymethyl)-7,12-dioxo-2,5,8,11-tetraazatetradec-13-en-14-yl]-2'-deoxyuridine 5'-(dihydrogen phosphate)

  • Molecular FormulaC24H35N6O16P
  • Average mass694.539 Da
  • Monoisotopic mass694.184692 Da
  • ChemSpider ID26339784

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

5-[(13E)-1-Carboxy-2,5-bis(carboxymethyl)-7,12-dioxo-2,5,8,11-tetraazatetradec-13-en-14-yl]-2'-deoxyuridine 5'-(dihydrogen phosphate) [ACD/IUPAC Name]
5-[(13E)-1-Carboxy-2,5-bis(carboxymethyl)-7,12-dioxo-2,5,8,11-tetraazatetradec-13-en-14-yl]-2'-desoxyuridin5'-(dihydrogenphosphat) [German] [ACD/IUPAC Name]
5-[(13E)-1-Carboxy-2,5-bis(carboxyméthyl)-7,12-dioxo-2,5,8,11-tétraazatétradéc-13-én-14-yl]-2'-désoxyuridine-5'-(dihydrogène phosphate) [French] [ACD/IUPAC Name]
Uridine, 5-[(1E)-14-carboxy-10,13-bis(carboxymethyl)-3,8-dioxo-4,7,10,13-tetraazatetradec-1-en-1-yl]-2'-deoxy-, 5'-(dihydrogen phosphate) [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.646
Molar Refractivity: 152.0±0.3 cm3
#H bond acceptors: 22
#H bond donors: 9
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 3
ACD/LogP: -3.91
ACD/LogD (pH 5.5): -9.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 332 Å2
Polarizability: 60.3±0.5 10-24cm3
Surface Tension: 96.1±3.0 dyne/cm
Molar Volume: 419.0±3.0 cm3

Click to predict properties on the Chemicalize site


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