Found 5 results

Search term: VRZYXKVDNUBKHN (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3Z,5S)-5-(2-Amino-2-oxoethyl)-3-[(2E,4E,6E,8E,10Z)-11-chloro-1-hydroxy-2,4,6,8,10-dodecapentaen-1-ylidene]-1-(alpha-D-xylopyranosyl)-2,4-pyrrolidinedione | C23H27ClN2O8

(3Z,5S)-5-(2-Amino-2-oxoethyl)-3-[(2E,4E,6E,8E,10Z)-11-chloro-1-hydroxy-2,4,6,8,10-dodecapentaen-1-ylidene]-1-(α-D-xylopyranosyl)-2,4-pyrrolidinedione

  • Molecular FormulaC23H27ClN2O8
  • Average mass494.922 Da
  • Monoisotopic mass494.145599 Da
  • ChemSpider ID28282457

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 5 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(3Z,5S)-5-(2-Amino-2-oxoethyl)-3-[(2E,4E,6E,8E,10Z)-11-chlor-1-hydroxy-2,4,6,8,10-dodecapentaen-1-yliden]-1-(α-D-xylopyranosyl)-2,4-pyrrolidindion [German] [ACD/IUPAC Name]
(3Z,5S)-5-(2-Amino-2-oxoethyl)-3-[(2E,4E,6E,8E,10Z)-11-chloro-1-hydroxy-2,4,6,8,10-dodecapentaen-1-ylidene]-1-(α-D-xylopyranosyl)-2,4-pyrrolidinedione [ACD/IUPAC Name]
(3Z,5S)-5-(2-Amino-2-oxoéthyl)-3-[(2E,4E,6E,8E,10Z)-11-chloro-1-hydroxy-2,4,6,8,10-dodécapentaén-1-ylidène]-1-(α-D-xylopyranosyl)-2,4-pyrrolidinedione [French] [ACD/IUPAC Name]
2,4-Pyrrolidinedione, 5-(2-amino-2-oxoethyl)-3-[(2E,4E,6E,8E,10Z)-11-chloro-1-hydroxy-2,4,6,8,10-dodecapentaen-1-ylidene]-1-α-D-xylopyranosyl-, (3Z,5S)- [ACD/Index Name]
aurantoside G

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

Density: 1.5±0.1 g/cm3
Boiling Point: 868.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 143.5±6.0 kJ/mol
Flash Point: 479.2±34.3 °C
Index of Refraction: 1.651
Molar Refractivity: 124.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 0.63
ACD/LogD (pH 5.5): -1.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.94
ACD/LogD (pH 7.4): -2.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 171 Å2
Polarizability: 49.3±0.5 10-24cm3
Surface Tension: 73.1±3.0 dyne/cm
Molar Volume: 340.5±3.0 cm3

Click to predict properties on the Chemicalize site


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