ChemSpider 2D Image | Isonocardicin A | C23H24N4O9

Isonocardicin A

  • Molecular FormulaC23H24N4O9
  • Average mass500.458 Da
  • Monoisotopic mass500.154327 Da
  • ChemSpider ID7827502

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 3 defined stereocentres

More details:

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

D-Homoserine, O-[4-[(1Z)-2-[[(3S)-1-[carboxy(4-hydroxyphenyl)methyl]-2-oxo-3-azetidinyl]amino]-1-(hydroxyimino)-2-oxoethyl]phenyl]- [ACD/Index Name]
Isonocardicin A
O-{4-[(1Z)-2-({(3S)-1-[Carboxy(4-hydroxyphenyl)methyl]-2-oxo-3-azetidinyl}amino)-N-hydroxy-2-oxoethanimidoyl]phenyl}-D-homoserin [German] [ACD/IUPAC Name]
O-{4-[(1Z)-2-({(3S)-1-[Carboxy(4-hydroxyphenyl)methyl]-2-oxo-3-azetidinyl}amino)-N-hydroxy-2-oxoethanimidoyl]phenyl}-D-homoserine [ACD/IUPAC Name]
O-{4-[(1Z)-2-({(3S)-1-[Carboxy(4-hydroxyphényl)méthyl]-2-oxo-3-azétidinyl}amino)-N-hydroxy-2-oxoethanimidoyl]phényl}-D-homosérine [French] [ACD/IUPAC Name]
1-Azetidineacetic acid [ACD/Index Name]
O-{4-[(1Z)-2-({(3S)-1-[carboxy(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl}amino)-N-hydroxy-2-oxoethanimidoyl]phenyl}-D-homoserine

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

C00927 [DBID]
CHEBI:16483 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.685
Molar Refractivity: 121.1±0.5 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 0.94
ACD/LogD (pH 5.5): -2.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 212 Å2
Polarizability: 48.0±0.5 10-24cm3
Surface Tension: 70.6±7.0 dyne/cm
Molar Volume: 318.5±7.0 cm3

Click to predict properties on the Chemicalize site


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