(4S)-9-Amino-4-Ethyl-4-Hydroxy-1H-Pyrano[3',4':6,7]Indolizino[1,2-B]Quinoline-3,14(4H,12H)-Dione

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Properties Simple | Detailed

Formula C20H17N3O4
IUPAC Name (19s)-7-amino-19-ethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaene-14,18-dione
Molecular Mass 363.367 g·mol−1
Heat of Formation -372.0 ± 16.7 kJ·mol−1
Dipole Moment 10.97 ± 1.08 D
Volume 398.1 Å 3
Surface Area 351.5 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy -1.45 ± eV
Point Group Symmetry C1
Synonyms
  • (4s)-9-amino-4-ethyl-4-hydroxy-1h-pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4h,12h)-dione
  • 1h-pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4h,12h)-dione, 9-amino-4-ethyl-4-hydroxy-, (s)-
CAS Number(s)
  • 86639-63-6
InChIKey MVUUMBZAHAKPKQ-FQEVSTJZSA-N
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