Gimatecan

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Properties Simple | Detailed

Formula C25H25N3O5+
IUPAC Name gimatecan
Molecular Mass 447.483 g·mol−1
Heat of Formation -456.3 ± 16.7 kJ·mol−1
Dipole Moment 7.54 ± 1.08 D
Volume 516.17 Å 3
Surface Area 437.42 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 1.37 ± eV
Point Group Symmetry C1
Synonyms
  • (4s)-11-((e)-((1,1-dimethylethoxy)imino)methyl)-4-ethyl-4-hydroxy-1,12-dihydro-14h-pyrano(3?,4?:6,7)indolizino(1,2-b)quinoline-3,14(4h)-dione
  • 1h-pyrano(3',4':6,7)indolizino(1,2-b)quinoline-11-carboxaldehyde, 4-ethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-, 11-(o-(1,1-dimethylethyl)oxime), (4s)-
  • 1h-pyrano(3',4':6,7)indolizino(1,2-b)quinoline-11-carboxaldehyde, 4-ethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-, 11-(o-(1,1-dimethylethyl)oxime), (c(e),4s)-
  • 7-tert-butoxyiminomethylcamptothecin
  • cpt 184
  • st 1481
CAS Number(s)
  • 292618-32-7
  • 292620-90-7
InChIKey UIVFUQKYVFCEKJ-OPTOVBNMSA-N
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