ChemSpider 2D Image | fusarimine | C17H21NO5

fusarimine

  • Molecular FormulaC17H21NO5
  • Average mass319.352 Da
  • Monoisotopic mass319.141968 Da
  • ChemSpider ID28536127

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

3-[(2R)-2-Butanyl]-6,8-dihydroxy-2-(2-hydroxyethyl)-4-methyl-7-isochinoliniumcarboxylat [German] [ACD/IUPAC Name]
3-[(2R)-2-Butanyl]-6,8-dihydroxy-2-(2-hydroxyéthyl)-4-méthyl-7-isoquinoléiniumcarboxylate [French] [ACD/IUPAC Name]
3-[(2R)-2-Butanyl]-6,8-dihydroxy-2-(2-hydroxyethyl)-4-methyl-7-isoquinoliniumcarboxylate [ACD/IUPAC Name]
fusarimine
Isoquinolinium, 7-carboxy-6,8-dihydroxy-2-(2-hydroxyethyl)-4-methyl-3-[(1R)-1-methylpropyl]-, inner salt [ACD/Index Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -1.23
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 105 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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