ChemSpider 2D Image | 2-({2-[2-{[(6-Amino-2-{3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl}-5-methyl-4-pyrimidinyl)carbonyl]amino}-3-{[5-({1-[(2-{4-[(4-aminobutyl)carbamoyl]-2,4'-bi-1,3-thiazol-2'-yl}-1-[(5-amino- 3,4-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-2-hydroxyethyl)amino]-3-hydroxy-1-oxo-2-butanyl}amino)-3-hydroxy-5-oxo-2-pentanyl]amino}-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxy methyl)tetrahydro-2H-pyran-3-yl}oxy)-3,5-dih | C59H91N19O26S2

2-({2-[2-{[(6-Amino-2-{3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl}-5-methyl-4-pyrimidinyl)carbonyl]amino}-3-{[5-({1-[(2-{4-[(4-aminobutyl)carbamoyl]-2,4'-bi-1,3-thiazol-2'-yl}-1-[(5-amino- 3,4-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-2-hydroxyethyl)amino]-3-hydroxy-1-oxo-2-butanyl}amino)-3-hydroxy-5-oxo-2-pentanyl]amino}-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxy methyl)tetrahydro-2H-pyran-3-yl}oxy)-3,5-dih

  • Molecular FormulaC59H91N19O26S2
  • Average mass1546.595 Da
  • Monoisotopic mass1545.582397 Da
  • ChemSpider ID135511

More details:

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

2-({2-[2-{[(6-Amino-2-{3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl}-5-methyl-4-pyrimidinyl)carbonyl]amino}-3-{[5-({1-[(2-{4-[(4-aminobutyl)carbamoyl]-2,4'-bi-1,3-thiazol-2'-yl}-1-[(5-amino- 3,4-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-2-hydroxyethyl)amino]-3-hydroxy-1-oxo-2-butanyl}amino)-3-hydroxy-5-oxo-2-pentanyl]amino}-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxy methyl)tetrahydro-2H-pyran-3-yl}oxy)-3,5-dih [ACD/IUPAC Name]
2-({2-[2-{[(6-Amino-2-{3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl}-5-methyl-4-pyrimidinyl)carbonyl]amino}-3-{[5-({1-[(2-{4-[(4-aminobutyl)carbamoyl]-2,4'-bi-1,3-thiazol-2'-yl}-1-[(5-amino- 3,4-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-2-hydroxyethyl)amino]-3-hydroxy-1-oxo-2-butanyl}amino)-3-hydroxy-5-oxo-2-pentanyl]amino}-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxy methyl)tetrahydro-2H-pyran-3-yl}oxy)-3,5-dih [German] [ACD/IUPAC Name]
Carbamate de 2-({2-[2-{[(6-amino-2-{3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl}-5-méthyl-4-pyrimidinyl)carbonyl]amino}-3-{[5-({1-[(2-{4-[(4-aminobutyl)carbamoyl]-2,4'-bi-1,3-thiazol-2'-yl} -1-[(5-amino-3,4-dihydroxy-6-méthyltétrahydro-2H-pyran-2-yl)oxy]-2-hydroxyéthyl)amino]-3-hydroxy-1-oxo-2-butanyl}amino)-3-hydroxy-5-oxo-2-pentanyl]amino}-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydro xy-6-(hydroxyméthyl)tétrahydro-2H-pyran-3-yl [French] [ACD/IUPAC Name]
76069-32-4 [RN]
Talisomycin S(sub 10b)
Tallysomycin S(sub 10b)
TALLYSOMYCIN S10B

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

BRN 4325250 [DBID]
NSC304426 [DBID]

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: 1.704
Molar Refractivity: 363.7±0.4 cm3
#H bond acceptors: 45
#H bond donors: 32
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 3
ACD/LogP: -1.09
ACD/LogD (pH 5.5): -9.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 815 Å2
Polarizability: 144.2±0.5 10-24cm3
Surface Tension: 116.7±5.0 dyne/cm
Molar Volume: 936.4±5.0 cm3

Click to predict properties on the Chemicalize site


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