(7R,9Ar,14Br,15As)-10-Acetyl-7-Methyl-14B-(2-Methyl-3-Buten-2-Yl)-10,14B,15,15A-Tetrahydroindolo[3'',2'':4',5']Pyrrolo[2',1':3,4]Pyrazino[2,1-B]Quinazoline-5,8(7H,9Ah)-Dione

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Formula C28H28N4O3
IUPAC Name (7r,9ar,14br,15as)-10-acetyl-7-methyl-14b-(2-methyl-3-buten-2-yl)-10,14b,15,15a-tetrahydroindolo[3'',2'':4',5']pyrrolo[2',1':3,4]pyrazino[2,1-b]quinazoline-5,8(7h,9ah)-dione
Molecular Mass 468.547 g·mol−1
Heat of Formation -241.0 ± 16.7 kJ·mol−1
Dipole Moment 4.17 ± 1.08 D
Volume 549.88 Å 3
Surface Area 425.74 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 1.98 ± eV
Point Group Symmetry C1
Synonyms
  • 5-n-acetylardeemin
  • indolo(3'',2'',4',5')pyrrolo(2',1',3,4)pyrazino(2,1-b)quinazoline-5,8(7h,9ah)-dione, 10-acetyl-14b-(1,1-dimethyl-2-propenyl)-10,14b,15,15a-tetrahydro-7-methyl-, (7alpha,9abeta,14bbeta,15aalpha)-(-)-
  • n-acetylardeemine
CAS Number(s)
  • 148441-26-3
InChIKey XTLQWSBGQKPGCF-YWDSKPHESA-N
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