ChemSpider 2D Image | 16,18-Dihydroxy-11-oxo-15-thia-9,13-diaza-4-azoniaheptacyclo[12.6.1.1~3,7~.0~1,16~.0~2,12~.0~4,19~.0~10,22~]docosa-2(12),3,7,10(22)-tetraene | C18H18N3O3S

16,18-Dihydroxy-11-oxo-15-thia-9,13-diaza-4-azoniaheptacyclo[12.6.1.13,7.01,16.02,12.04,19.010,22]docosa-2(12),3,7,10(22)-tetraene

  • Molecular FormulaC18H18N3O3S
  • Average mass356.418 Da
  • Monoisotopic mass356.106323 Da
  • ChemSpider ID24627566

  • Charge - Charge

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

16,18-Dihydroxy-11-oxo-15-thia-9,13-diaza-4-azoniaheptacyclo[12.6.1.13,7.01,16.02,12.04,19.010,22]docosa-2(12),3,7,10(22)-tetraen [German] [ACD/IUPAC Name]
16,18-Dihydroxy-11-oxo-15-thia-9,13-diaza-4-azoniaheptacyclo[12.6.1.13,7.01,16.02,12.04,19.010,22]docosa-2(12),3,7,10(22)-tetraene [ACD/IUPAC Name]
16,18-Dihydroxy-11-oxo-15-thia-9,13-diaza-4-azoniaheptacyclo[12.6.1.13,7.01,16.02,12.04,19.010,22]docosa-2(12),3,7,10(22)-tétraène [French] [ACD/IUPAC Name]
2H-7,9-Epithio-8a,12-methanoazocino[4,3,2,1-lmn]pyrrolo[4,3,2-de][1,7]phenanthrolin-13-ium, 1,4,5,6,7,8,9,10,11,12-decahydro-9,11-dihydroxy-5-oxo- [ACD/Index Name]
(+)-discorhabdin X

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 114 Å2
Polarizability:
Surface Tension:
Molar Volume:

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