ChemSpider 2D Image | tyrocidine A | C66H87N13O13

tyrocidine A

  • Molecular FormulaC66H87N13O13
  • Average mass1270.476 Da
  • Monoisotopic mass1269.654663 Da
  • ChemSpider ID17286446

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

1481-70-5 [RN]
Cyclo(L-asparaginyl-L-glutaminyl-L-tyrosyl-L-valyl-L-ornithyl-L-leucyl-D-phenylalanyl-L-prolyl-L-phenylalanyl-D-phenylalanyl) [ACD/Index Name] [ACD/IUPAC Name]
Cyclo(L-asparaginyl-L-glutaminyl-L-tyrosyl-L-valyl-L-ornithyl-L-leucyl-D-phenylalanyl-L-prolyl-L-phenylalanyl-D-phenylalanyl) [German] [ACD/Index Name] [ACD/IUPAC Name]
Cyclo(L-asparaginyl-L-glutaminyl-L-tyrosyl-L-valyl-L-ornithyl-L-leucyl-D-phénylalanyl-L-prolyl-L-phénylalanyl-D-phénylalanyl) [French] [ACD/IUPAC Name]
tyrocidine A
8011-61-8 [RN]
C12041
cyclo-(D-PheProPhe-D-PheAsnGlnTyrValOrnLeu)
cyclo-(D-Phe-Pro-Phe-D-Phe-Asn-Gln-Tyr-Val-Orn-Leu)
Cyclo(D-Phe-Pro-Phe-D-Phe-Asn-Gln-Tyr-Val-Orn-Leu-)
More...

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

V134656H89 [DBID]
UNII:V134656H89 [DBID]
UNII-V134656H89 [DBID]
  • Miscellaneous

    • Chemical Class:

      A homodetic cyclic decapeptide consisting of <stereo>D</stereo>-Phe, <stereo>L</stereo>-Pro, <stereo>L</stereo>-Phe, <stereo>D</stereo>-Phe, <stereo>L</stereo>-Asn, <stereo>L</stereo>-Gln, <stereo>L</ stereo>-Tyr, <stereo>L</stereo>-Val, <stereo>L</stereo>-Orn, and <stereo>L</stereo>-Leu residues coupled in sequence and cyclised head-to-tail. ChEBI CHEBI:29701
      A homodetic cyclic decapeptide consisting of D-Phe, L-Pro, L-Phe, D-Phe, L-Asn, L-Gln, L-Tyr, L-Val, L-Orn, and L-Leu residues coupled in sequence and cyclised head-to-tail. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:29701, CHEBI:29701

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1630.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 265.4±3.0 kJ/mol
Flash Point: 940.0±34.3 °C
Index of Refraction: 1.638
Molar Refractivity: 341.6±0.4 cm3
#H bond acceptors: 26
#H bond donors: 16
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: -1.02
ACD/LogD (pH 5.5): -3.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 415 Å2
Polarizability: 135.4±0.5 10-24cm3
Surface Tension: 72.4±5.0 dyne/cm
Molar Volume: 950.4±5.0 cm3

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