Found 5 results

Search term: MF = 'C_{73}H_{112}N_{12}O_{20}'
ChemSpider 2D Image | CSID:8436435 | C73H112N12O20

  • Molecular FormulaC73H112N12O20
  • Average mass1477.739 Da
  • Monoisotopic mass1476.811523 Da
  • ChemSpider ID8436435

  • defined stereocentres - 12 of 14 defined stereocentres

More details:

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

N-(2-Hydroxy-5-methylhexadecanoyl)-L-α-glutamyl-N-[(4S,7S,10S,13S,19S,22S,25S,28S)-10-(3-amino-3-oxopropyl)-4-[(2S)-2-butanyl]-22-(2-carboxyethyl)-7-(4-hydroxybenzyl)-25-[(1R)-1-hydroxyethyl]-19-m ethyl-3,6,9,12,18,21,24,27-octaoxo-2-oxa-5,8,11,17,20,23,26-heptaazatricyclo[28.2.2.013,17]tetratriaconta-1(32),30,33-trien-28-yl]-L-ornithinamid [German] [ACD/IUPAC Name]
N-(2-Hydroxy-5-méthylhexadecanoyl)-L-α-glutamyl-N-[(4S,7S,10S,13S,19S,22S,25S,28S)-10-(3-amino-3-oxopropyl)-4-[(2S)-2-butanyl]-22-(2-carboxyéthyl)-7-(4-hydroxybenzyl)-25-[(1R)-1-hydroxyéthyl]-19-m éthyl-3,6,9,12,18,21,24,27-octaoxo-2-oxa-5,8,11,17,20,23,26-heptaazatricyclo[28.2.2.013,17]tétratriaconta-1(32),30,33-trién-28-yl]-L-ornithinamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1684.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 279.4±3.0 kJ/mol
Flash Point: 972.5±34.3 °C
Index of Refraction: 1.601
Molar Refractivity: 384.6±0.4 cm3
#H bond acceptors: 32
#H bond donors: 18
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 3
ACD/LogP: 2.60
ACD/LogD (pH 5.5): -0.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 513 Å2
Polarizability: 152.5±0.5 10-24cm3
Surface Tension: 70.2±5.0 dyne/cm
Molar Volume: 1122.4±5.0 cm3

Click to predict properties on the Chemicalize site


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