Found 1 result

Search term: BOLXAGHGKNGVBE-MTXRGOKVSA-K (Found by InChIKey (full match))

ChemSpider 2D Image | 2-O-(6-phospho-alpha-D-mannosyl)-D-glycerate | C9H14O12P


  • Molecular FormulaC9H14O12P
  • Average mass345.176 Da
  • Monoisotopic mass345.023926 Da
  • ChemSpider ID26331883
  • Charge - Charge

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(2R)-3-Hydroxy-2-[(6-O-phosphonato-α-D-mannopyranosyl)oxy]propanoat [German] [ACD/IUPAC Name]
(2R)-3-Hydroxy-2-[(6-O-phosphonato-α-D-mannopyranosyl)oxy]propanoate [ACD/IUPAC Name]
(2R)-3-Hydroxy-2-[(6-O-phosphonato-α-D-mannopyranosyl)oxy]propanoate [French] [ACD/IUPAC Name]
Propanoic acid, 3-hydroxy-2-[(6-O-phosphono-α-D-mannopyranosyl)oxy]-, ion(3-), (2R)- [ACD/Index Name]

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

CHEBI:60331 [DBID]
  • Miscellaneous
    • Chemical Class:

      An organophosphate oxoanion derived from 2-O-(6-phosphono-alpha-D-mannosyl)-D-glyceric acid by removal of the two protons from the; phosphate group and the proton from the carboxylic acid group. ChEBI CHEBI:60331

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

Boiling Point: 775.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.0 mmHg at 25°C
Enthalpy of Vaporization: 128.7±6.0 kJ/mol
Flash Point: 423.0±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -1.14
ACD/LogD (pH 5.5): -7.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 222 Å2
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site