ChemSpider 2D Image | Hexopyranosyl-(1->3)-[hexopyranosyl-(1->6)]hexopyranosyl-(1->4)-2-acetamido-2-deoxyhexopyranosyl-(1->4)-2-acetamido-2-deoxy-1-O-[{[{[(6Z,10Z,14Z,18E,22Z,26Z,30Z,34E,38Z,42Z,46Z,50E,54Z,58Z)-3,7,11,15, 19,23,27,31,35,39,43,47,51,55,59,63-hexadecamethyl-6,10,14,18,22,26,30,34,38,42,46,50,54,58,62-tetrahexacontapentadecaen-1-yl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]hexopyranose | C114H190N2O32P2

Hexopyranosyl-(1->3)-[hexopyranosyl-(1->6)]hexopyranosyl-(1->4)-2-acetamido-2-deoxyhexopyranosyl-(1->4)-2-acetamido-2-deoxy-1-O-[{[{[(6Z,10Z,14Z,18E,22Z,26Z,30Z,34E,38Z,42Z,46Z,50E,54Z,58Z)-3,7,11,15, 19,23,27,31,35,39,43,47,51,55,59,63-hexadecamethyl-6,10,14,18,22,26,30,34,38,42,46,50,54,58,62-tetrahexacontapentadecaen-1-yl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]hexopyranose

  • Molecular FormulaC114H190N2O32P2
  • Average mass2162.670 Da
  • Monoisotopic mass2161.277588 Da
  • ChemSpider ID24808193

  • Double-bond stereo - Double-bond stereo

More details:

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

Hexopyranose, O-hexopyranosyl-(1->3)-O-[hexopyranosyl-(1->6)]-O-hexopyranosyl-(1->4)-O--2-(acetylamino)-2-deoxyhexopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-1-O-[[[[[(6Z,10Z,14Z,18E,22Z,26Z,30Z,34E,38Z ,42Z,46Z,50E,54Z,58Z)-3,7,11,15,19,23,27,31,35,39,43,47,51,55,59,63-hexadecamethyl-6,10,14,18,22,26,30,34,38,42,46,50,54,58,62-tetrahexacontapentadecaen-1-yl]oxy]hydroxyphosphinyl]oxy]hydroxyphosphiny l]- [ACD/Index Name]
Hexopyranosyl-(1->3)-[hexopyranosyl-(1->6)]hexopyranosyl-(1->4)-2-acetamido-2-deoxyhexopyranosyl-(1->4)-2-acetamido-2-deoxy-1-O-[{[{[(6Z,10Z,14Z,18E,22Z,26Z,30Z,34E,38Z,42Z,46Z,50E,54Z,58Z)-3,7,11,15, 19,23,27,31,35,39,43,47,51,55,59,63-hexadecamethyl-6,10,14,18,22,26,30,34,38,42,46,50,54,58,62-tetrahexacontapentadecaen-1-yl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]hexopyranose [ACD/IUPAC Name]
Hexopyranosyl-(1->3)-[hexopyranosyl-(1->6)]hexopyranosyl-(1->4)-2-acetamido-2-desoxyhexopyranosyl-(1->4)-2-acetamido-2-desoxy-1-O-[{[{[(6Z,10Z,14Z,18E,22Z,26Z,30Z,34E,38Z,42Z,46Z,50E,54Z,58Z)-3,7,11,1 5,19,23,27,31,35,39,43,47,51,55,59,63-hexadecamethyl-6,10,14,18,22,26,30,34,38,42,46,50,54,58,62-tetrahexacontapentadecaen-1-yl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]hexopyranose [German] [ACD/IUPAC Name]
Hexopyranosyl-(1->3)-[hexopyranosyl-(1->6)]hexopyranosyl-(1->4)-2-acétamido-2-désoxyhexopyranosyl-(1->4)-2-acétamido-2-désoxy-1-O-[{[{[(6Z,10Z,14Z,18E,22Z,26Z,30Z,34E,38Z,42Z,46Z,50E,54Z,58Z)-3,7,11,1 5,19,23,27,31,35,39,43,47,51,55,59,63-hexadécaméthyl-6,10,14,18,22,26,30,34,38,42,46,50,54,58,62-tétrahexacontapentadécaén-1-yl]oxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]hexopyranose [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.576
Molar Refractivity: 580.9±0.4 cm3
#H bond acceptors: 34
#H bond donors: 18
#Freely Rotating Bonds: 68
#Rule of 5 Violations: 4
ACD/LogP: 23.68
ACD/LogD (pH 5.5): 13.52
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 4834833.00
ACD/LogD (pH 7.4): 13.52
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 4756887.50
Polar Surface Area: 546 Å2
Polarizability: 230.3±0.5 10-24cm3
Surface Tension: 59.7±5.0 dyne/cm
Molar Volume: 1756.1±5.0 cm3

Click to predict properties on the Chemicalize site


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