Asperlicin

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Properties Simple | Detailed

Formula C31H29N5O4
IUPAC Name (7s)-7-[[(2s,3as,4s)-4-hydroxy-2-isobutyl-1-oxo-3,3a-dihydro-2h-imidazo[1,2-a]indol-4-yl]methyl]-6,7-dihydroquinazolino[3,2-a][1,4]benzodiazepine-5,13-dione
Molecular Mass 535.593 g·mol−1
Heat of Formation -313.9 ± 16.7 kJ·mol−1
Dipole Moment 4.26 ± 1.08 D
Volume 615.76 Å 3
Surface Area 471.19 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 2.04 ± eV
Point Group Symmetry C1
Synonyms
  • (s-(2alpha,9beta,9(r*),9alpha,beta))-6,7-dihydro-7-((2,3,9,9a-tetrahydro-9-hydroxy-2-(2-methylpropyl)-3-oxo-1h-imidazo(1,2-a)indol-9-yl)methyl)quinazolino(3,2-a)(1,4)benzodiazepine-5,13-dione
  • quinazolino(3,2-a)(1,4)benzodiazepine-5,13-dione, 6,7-dihydro-7-((2,3,9,9a-tetrahydro-9-hydroxy-2-(2-methylpropyl)-3-oxo-1h-imidazo(1,2-a)indol-9-yl)methyl)-, (2s-(2alpha,9beta,9(r*),9abeta))-
InChIKey MGMRIOLWEROPJY-FPACPZPDSA-N
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