ChemSpider 2D Image | GE2270 A | C56H55N15O10S6

GE2270 A

  • Molecular FormulaC56H55N15O10S6
  • Average mass1290.520 Da
  • Monoisotopic mass1289.258057 Da
  • ChemSpider ID17314948

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

1-{[(4S)-2-{2-[(18S,25S,35S)-35-[(S)-Hydroxy(phenyl)methyl]-25-isopropyl-28-(methoxymethyl)-21-methyl-18-[2-(methylamino)-2-oxoethyl]-16,23,30,33-tetraoxo-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,4 ;1,42,43-decaazaheptacyclo[34.2.1.12,5.112,15.119,22.126,29.06,11]tritetraconta-1(38),2(43),4,6,8,10,12(42),14,19(41),21,26(40),28,36(39)-tridecaen-8-yl]-1,3-thiazol-4-yl}-4,5-dihydro-1,3-oxa 
zol-4-yl]carbonyl}-L-prolinamid [German] [ACD/IUPAC Name]
1-{[(4S)-2-{2-[(18S,25S,35S)-35-[(S)-Hydroxy(phenyl)methyl]-25-isopropyl-28-(methoxymethyl)-21-methyl-18-[2-(methylamino)-2-oxoethyl]-16,23,30,33-tetraoxo-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,4 ;1,42,43-decaazaheptacyclo[34.2.1.12,5.112,15.119,22.126,29.06,11]tritetraconta-1(38),2(43),4,6,8,10,12(42),14,19(41),21,26(40),28,36(39)-tridecaen-8-yl]-1,3-thiazol-4-yl}-4,5-dihydro-1,3-oxa 
zol-4-yl]carbonyl}-L-prolinamide [ACD/IUPAC Name]
1-{[(4S)-2-{2-[(18S,25S,35S)-35-[(S)-Hydroxy(phényl)méthyl]-25-isopropyl-28-(méthoxyméthyl)-21-méthyl-18-[2-(méthylamino)-2-oxoéthyl]-16,23,30,33-tétraoxo-3,13,20,27,37-pentathia-7,17,24,31,34,39,40,4 ;1,42,43-décaazaheptacyclo[34.2.1.12,5.112,15.119,22.126,29.06,11]tritétraconta-1(38),2(43),4,6,8,10,12(42),14,19(41),21,26(40),28,36(39)-tridécaén-8-yl]-1,3-thiazol-4-yl}-4,5-dihydro-1,3-oxa 
zol-4-yl]carbonyl}-L-prolinamide [French] [ACD/IUPAC Name]
134861-34-0 [RN]
GE2270 A
JB4J58L2K1
Antibiotic GE 2270A
GE-2270A
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL1766417/
UNII:JB4J58L2K1

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.833
Molar Refractivity: 333.7±0.5 cm3
#H bond acceptors: 25
#H bond donors: 8
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 0.81
ACD/LogD (pH 5.5): 1.20
ACD/BCF (pH 5.5): 4.84
ACD/KOC (pH 5.5): 107.52
ACD/LogD (pH 7.4): 1.20
ACD/BCF (pH 7.4): 4.84
ACD/KOC (pH 7.4): 107.50
Polar Surface Area: 520 Å2
Polarizability: 132.3±0.5 10-24cm3
Surface Tension: 78.4±7.0 dyne/cm
Molar Volume: 757.8±7.0 cm3

Click to predict properties on the Chemicalize site


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