ChemSpider 2D Image | streptonigrin | C25H22N4O8

streptonigrin

  • Molecular FormulaC25H22N4O8
  • Average mass506.464 Da
  • Monoisotopic mass506.143768 Da
  • ChemSpider ID10207545

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

1261
223-501-8 [EINECS]
261Q3JB310
2-Pyridinecarboxylic acid, 5-amino-6-(7-amino-5,8-dihydro-6-methoxy-5,8-dioxo-2-quinolinyl)-4-(2-hydroxy-3,4-dimethoxyphenyl)-3-methyl- [ACD/Index Name]
3930-19-6 [RN]
5278RP
599390
5-Amino-6-(7-amino-5,8-dihydro-6-methoxy-5,8-dioxo-2-quinolyl)-4-(2-hydroxy-3,4-dimethoxyphenyl)-3-methyl-2-pyridinecarboxylic Acid
5-Amino-6-(7-amino-6-methoxy-5,8-dioxo-5,8-dihydro-2-chinolinyl)-4-(2-hydroxy-3,4-dimethoxyphenyl)-3-methyl-2-pyridincarbonsäure [German] [ACD/IUPAC Name]
5-Amino-6-(7-amino-6-methoxy-5,8-dioxo-5,8-dihydro-2-quinolinyl)-4-(2-hydroxy-3,4-dimethoxyphenyl)-3-methyl-2-pyridinecarboxylic acid [ACD/IUPAC Name]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AI3-52152 [DBID]
BRN 0599390 [DBID]
CCRIS 1264 [DBID]
NSC 45383 [DBID]
NSC-45383 [DBID]
S1014_SIGMA [DBID]
  • Miscellaneous
    • Chemical Class:

      Complex cytotoxic antibiotic obtained from <ital>Streptomyces flocculus</ital> or <ital>S. rufochronmogenus</ital>. It is used in advanced carcinoma and causes leukopenia. ChEBI CHEBI:9287
  • Gas Chromatography

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 736.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 112.7±3.0 kJ/mol
Flash Point: 399.0±32.9 °C
Index of Refraction: 1.716
Molar Refractivity: 126.7±0.4 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: -0.43
ACD/LogD (pH 5.5): -1.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 197 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 95.6±5.0 dyne/cm
Molar Volume: 322.3±5.0 cm3

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