ChemSpider 2D Image | (E,Z)-bastadin 19 | C34H27Br5N4O8

(E,Z)-bastadin 19

  • Molecular FormulaC34H27Br5N4O8
  • Average mass1019.120 Da
  • Monoisotopic mass1013.774536 Da
  • ChemSpider ID23326973

  • Double-bond stereo - Double-bond stereo

More details:

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

(12E,25Z)-5,16,21,32,36-Pentabrom-4,17-dihydroxy-12,25-bis(hydroxyimino)-2,19-dioxa-10,27-diazapentacyclo[28.2.2.220,23.13,7.114,18]octatriaconta-1(32),3(38),4,6,14(37),15,17,20,22,30,33,35-dode caen-11,26-dion [German] [ACD/IUPAC Name]
(12E,25Z)-5,16,21,32,36-Pentabromo-4,17-dihydroxy-12,25-bis(hydroxyimino)-2,19-dioxa-10,27-diazapentacyclo[28.2.2.220,23.13,7.114,18]octatriaconta-1(32),3(38),4,6,14(37),15,17,20,22,30,33,35-dod ecaene-11,26-dione [ACD/IUPAC Name]
(12E,25Z)-5,16,21,32,36-Pentabromo-4,17-dihydroxy-12,25-bis(hydroxyimino)-2,19-dioxa-10,27-diazapentacyclo[28.2.2.220,23.13,7.114,18]octatriaconta-1(32),3(38),4,6,14(37),15,17,20,22,30,33,35-dod écaène-11,26-dione [French] [ACD/IUPAC Name]
(E,Z)-bastadin 19
2,19-Dioxa-10,27-diazapentacyclo[28.2.2.220,23.13,7.114,18]octatriaconta-3,5,7(38),14,16,18(37),20,22,30,32,33,35-dodecaene-11,12,25,26-tetrone, 5,16,21,32,36-pentabromo-4,17-dihydroxy-, 12,25-d ioxime, (12E,25Z)- [ACD/Index Name]
(12E,25Z)-5,16,21,32,36-pentabromo-4,17-dihydroxy-12,25-bis(hydroxyimino)-2,19-dioxa-10,27-diazapentacyclo[28.2.2.2(20,23).1(3,7).1(14,18)]octatriaconta-1(32),3(38),4,6,14(37),15,17,20,22,30,33,35-dod
(12E,25Z)-5,16,21,32,36-pentabromo-4,17-dihydroxy-12,25-bis(hydroxyimino)-2,19-dioxa-10,27-diazapentacyclo[28.2.2.2(20,23).1(3,7).1(14,18)]octatriaconta-1(32),3(38),4,6,14(37),15,17,20,22,30,33,35-dodecaene-11,26-dione
(12E,25Z)-5,16,21,32,36-pentabromo-4,17-dihydroxy-12,25-bis(hydroxyimino)-2,19-dioxa-10,27-diazapentacyclo[28.2.2.220,23.13,7.114,18]octatriaconta-1(32),3(38),4,6,14(37),15,17,20,22,30,33,35-dodecaene-11,26-dione
2,19-dioxa-10,27-diazapentacyclo[28.2.2.220,23.13,7.114,18]octatriaconta-3,5,7(38),14,16,18(37),20,22,30,32,33,35-dodecaene-11,12,25,26-tetrone, 5,16,21,32,36-pentabromo-4,17-dihydroxy-, 12,25-dioxime, (12E,25Z)-
Bastadin-19
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  • Miscellaneous

    • Chemical Class:

      A macrocyclic lactam with oximo amide groups having a -<stereo>E</stereo>,<stereo>Z</stereo> configuration. Isolated from the marine sponge <ital>Ianthella</ital>, it has been shown to exhibit calcium channel modulatory activity. ChEBI CHEBI:68322
      A macrocyclic lactam with oximo amide groups having a -E,Z configuration. Isolated from the marine sponge Ianthella, it has been shown to exhibit calcium channel modulatory activity. ChEBI CHEBI:68322
      A macrocyclic lactam with oximo amide groups having a -E,Z configuration. Isolated from the marine sponge Ianthella, it has been shown to exhibit calcium; channel modulatory activity. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:68322

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.726
Molar Refractivity: 204.4±0.5 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 4
ACD/LogP: 8.06
ACD/LogD (pH 5.5): 7.43
ACD/BCF (pH 5.5): 260187.56
ACD/KOC (pH 5.5): 257920.67
ACD/LogD (pH 7.4): 6.53
ACD/BCF (pH 7.4): 32385.51
ACD/KOC (pH 7.4): 32103.35
Polar Surface Area: 182 Å2
Polarizability: 81.0±0.5 10-24cm3
Surface Tension: 65.5±7.0 dyne/cm
Molar Volume: 514.0±7.0 cm3

Click to predict properties on the Chemicalize site


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