Found 4 results

Search term: AGTCBVBMJBPVIF (Found by InChIKey (skeleton match))
ChemSpider 2D Image | isoagelasine C | C26H40N5

isoagelasine C

  • Molecular FormulaC26H40N5
  • Average mass422.629 Da
  • Monoisotopic mass422.327820 Da
  • ChemSpider ID62285075

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

6-Amino-9-méthyl-7-{(2E)-3-méthyl-5-[(1S,2S,4aS)-1,2,5,5-tétraméthyl-1,2,3,4,4a,5,6,7-octahydro-1-naphtalényl]-2-pentén-1-yl}-9H-purin-7-ium [French] [ACD/IUPAC Name]
6-Amino-9-methyl-7-{(2E)-3-methyl-5-[(1S,2S,4aS)-1,2,5,5-tetramethyl-1,2,3,4,4a,5,6,7-octahydro-1-naphthalenyl]-2-penten-1-yl}-9H-purin-7-ium [ACD/IUPAC Name]
6-Amino-9-methyl-7-{(2E)-3-methyl-5-[(1S,2S,4aS)-1,2,5,5-tetramethyl-1,2,3,4,4a,5,6,7-octahydro-1-naphthalinyl]-2-penten-1-yl}-9H-purin-7-ium [German] [ACD/IUPAC Name]
9H-Purinium, 6-amino-9-methyl-7-[(2E)-3-methyl-5-[(1S,2S,4aS)-1,2,3,4,4a,5,6,7-octahydro-1,2,5,5-tetramethyl-1-naphthalenyl]-2-penten-1-yl]- [ACD/Index Name]
isoagelasine C

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: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations:
ACD/LogP:
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: 61 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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