Latrunculin A

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Properties Simple | Detailed

Formula C22H31NO5S
IUPAC Name (4r)-4-[(1r,4s,5z,7e,11z,15r,17r)-17-hydroxy-4,11-dimethyl-13-oxo-14,18-dioxabicyclo[13.3.1]nonadeca-5,7,11-trien-17-yl]thiazolidin-2-one
Molecular Mass 421.550 g·mol−1
Heat of Formation -939.7 ± 16.7 kJ·mol−1
Dipole Moment 7.07 ± 1.08 D
Volume 511.07 Å 3
Surface Area 375.01 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -0.46 ± eV
Point Group Symmetry C1
Synonyms
  • (4r)-4-[(1r,4s,5z,7e,11z,15r,17r)-17-hydroxy-13-keto-4,11-dimethyl-14,18-dioxabicyclo[13.3.1]nonadeca-5,7,11-trien-17-yl]thiazolidin-2-one
  • (4r)-4-[(1r,4s,5z,7e,11z,15r,17r)-17-hydroxy-4,11-dimethyl-13-oxo-14,18-dioxabicyclo[13.3.1]nonadeca-5,7,11-trien-17-yl]-1,3-thiazolidin-2-one
  • (4r)-4-[(1r,4s,5z,7e,11z,15r,17r)-17-hydroxy-4,11-dimethyl-13-oxo-14,18-dioxabicyclo[13.3.1]nonadeca-5,7,11-trien-17-yl]-2-thiazolidinone
  • (4r)-4-[(1r,4s,5z,7e,11z,15r,17r)-17-hydroxy-4,11-dimethyl-13-oxo-14,18-dioxabicyclo[13.3.1]nonadeca-5,7,11-trien-17-yl]thiazolidin-2-one
  • 2-thiazolidinone, 4-(17-hydroxy-5,12-dimethyl-3-oxo-2,16- dioxabicyclo[13.3.1]nonadeca-4,8,10-trien-17-yl)-, [1r-[1r*,4z,8e,10z,12s*,15r*,17r*(r*)]]-
  • 2-thiazolidinone, 4-[(1r,4z,8e,10z,12s,15r,17r)-17-hydroxy-5,12-dimethyl-3-oxo-2,16-dioxabicyclo[13.3.1]nonadeca-4,8,10-trien-17-yl]-, (4r)-
  • 4-(17-hydroxy-5,12-dimethyl-3-oxo-2,16-dioxabicyclo[13.3.1]nonadeca-4,8,10-trien-17-yl)-2-thiazolidinone
  • lar
CAS Number(s)
  • 76343-93-6
InChIKey DDVBPZROPPMBLW-IZGXTMSKSA-N
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