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

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Properties Simple | Detailed

Formula C20H16N2O5
IUPAC Name (19s)-19-hydroxy-19-(2-hydroxyethyl)-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
Molecular Mass 364.351 g·mol−1
Heat of Formation -524.7 ± 16.7 kJ·mol−1
Dipole Moment 8.59 ± 1.08 D
Volume 394.16 Å 3
Surface Area 349.24 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -1.76 ± eV
Point Group Symmetry C1
Synonyms
  • 18-hydroxycamptothecin
  • 1h-pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4h,12h)-dione, 4-hydroxy-4-(2-hydroxyethyl)-, (s)-
CAS Number(s)
  • 116139-46-9
InChIKey CCBXXGSAGQNXHX-FQEVSTJZSA-N
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