ChemSpider 2D Image | 5-Oxo-L-prolyl-L-tryptophyl-L-prolyl-N~5~-(diaminomethylene)-L-ornithyl-L-prolyl-D-glutaminyl-L-isoleucyl-L-prolyl-L-proline | C53H76N14O12

5-Oxo-L-prolyl-L-tryptophyl-L-prolyl-N5-(diaminomethylene)-L-ornithyl-L-prolyl-D-glutaminyl-L-isoleucyl-L-prolyl-L-proline

  • Molecular FormulaC53H76N14O12
  • Average mass1101.257 Da
  • Monoisotopic mass1100.576660 Da
  • ChemSpider ID4470955

  • defined stereocentres - 9 of 10 defined stereocentres

More details:

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

5-Oxo-L-prolyl-L-tryptophyl-L-prolyl-N5-(diaminomethylen)-L-ornithyl-L-prolyl-D-glutaminyl-L-isoleucyl-L-prolyl-L-prolin [German] [ACD/IUPAC Name]
5-Oxo-L-prolyl-L-tryptophyl-L-prolyl-N5-(diaminomethylene)-L-ornithyl-L-prolyl-D-glutaminyl-L-isoleucyl-L-prolyl-L-proline [ACD/IUPAC Name]
5-Oxo-L-prolyl-L-tryptophyl-L-prolyl-N5-(diaminométhylène)-L-ornithyl-L-prolyl-D-glutaminyl-L-isoleucyl-L-prolyl-L-proline [French] [ACD/IUPAC Name]
L-Proline, 5-oxo-L-prolyl-L-tryptophyl-L-prolyl-N5-(diaminomethylene)-L-ornithyl-L-prolyl-D-glutaminyl-L-isoleucyl-L-prolyl- [ACD/Index Name]
(2S)-1-[(2S)-1-[(2S)-2-[[(2R)-5-amino-2-[[(2S)-1-[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-1-[(2S)-3-(1H-indol-3-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]pentanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
35115-60-7 [RN]
Angiotensin Converting Enzyme Inhibitor
angiotensin convertingenzyme inhibitor
pyr-trp-pro-arg-pro-gln-ile-pro-pro-oh
Teprotide [INN]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.719
Molar Refractivity: 281.8±0.5 cm3
#H bond acceptors: 26
#H bond donors: 13
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 3
ACD/LogP: -0.75
ACD/LogD (pH 5.5): -4.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 387 Å2
Polarizability: 111.7±0.5 10-24cm3
Surface Tension: 70.2±7.0 dyne/cm
Molar Volume: 713.9±7.0 cm3

Click to predict properties on the Chemicalize site


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