(5Ar,7As,8Ar,13As,15As,16As)-8A,16A-Dihydroxy-5A,13A-Bis(2-Methyl-3-Buten-2-Yl)-5A,8,8A,13,13A,15A,16,16A-Octahydroindolo[3''',2''':4'',5'']Pyrrolo[1'',2'':4',5']Pyrazino[1',2':1,5]Pyrrolo[2,3-B]Indole-7,15(5H,7Ah)-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C27H19N4O4
IUPAC Name (5ar,7as,8ar,13as,15as,16as)-8a,16a-dihydroxy-5a,13a-bis(2-methyl-3-buten-2-yl)-5a,8,8a,13,13a,15a,16,16a-octahydroindolo[3''',2''':4'',5'']pyrrolo[1'',2'':4',5']pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-7,15(5h,7ah)-dione
Molecular Mass 463.464 g·mol−1
Heat of Formation -415.4 ± 16.7 kJ·mol−1
Dipole Moment 0.43 ± 1.08 D
Volume 632.94 Å 3
Surface Area 438.59 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -0.36 ± eV
Point Group Symmetry C1
Synonyms
  • 8a,16a-dihydroxy-5a,13a-bis(1,1-dimethylallyl)-(1)-benzazolidine-(3''',2''':4'',5'')azolidino-(1'',2'':4',5')(1,4)perhydrodiazin-(1',2':1,5)azolidino-(2,3-b)-(1)-benzazolidine-7,15-dione
  • pyrazino(1'',2'':1,5;4'',5'':1',5')dipyrrolo(2,3-b:2',3'-b')diindole-7,15(5h,7ah)-dione, 5a,13a-bis(1,1-dimethyl-2-propenyl)-5a,8,8a,13,13a,15a,16,16a-octahydro-8a,16a-dihydroxy-, (5aalpha,7aalpha,8abeta,13abeta,15aalpha,16aalpha)-
CAS Number(s)
  • 155114-38-8
InChIKey CXDDBHFLLPBKRS-OVYULKEKSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N