(5aalpha,7aalpha,8abeta,13abeta,15aalpha,16aalpha)-5a,13a-Bis(1,1-dimethyl-2-propenyl)-5a,8,8a,13,13a,15a,16,16a-octahydro-8a,16a-dihydroxy-Pyrazino(1'',2'':1,5:4'',5'':1',5')dipyrrolo(2,3-b:2',3'-b')diindole-7,15(5H,7aH)-dione
[CAS# 155114-38-8]

Identification

• Name: (5aalpha,7aalpha,8abeta,13abeta,15aalpha,16aalpha)-5a,13a-Bis(1,1-dimethyl-2-propenyl)-5a,8,8a,13,13a,15a,16,16a-octahydro-8a,16a-dihydroxy-Pyrazino(1'',2'':1,5:4'',5'':1',5')dipyrrolo(2,3-b:2',3'-b')diindole-7,15(5H,7aH)-dione
• 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; Gypsetin
• Molecular Formula: C₃₂H₃₆N₄O₄
• Molecular Weight: 540.66
• CAS Registry Number: 155114-38-8
• SMILES: [C@]57(N3[C@H](C(=O)N2[C@@]1(NC4=C([C@]1(O)C[C@H]2C3=O)C=CC=C4)C(C=C)(C)C)C[C@]5(O)C6=CC=CC=C6N7)C(C=C)(C)C
• InChI: 1S/C32H36N4O4/c1-7-27(3,4)31-29(39,19-13-9-11-15-21(19)33-31)17-23-26(38)36-24(25(37)35(23)31)18-30(40)20-14-10-12-16-22(20)34-32(30,36)28(5,6)8-2/h7-16,23-24,33-34,39-40H,1-2,17-18H2,3-6H3/t23-,24-,29-,30+,31+,32-/m0/s1
• InChIKey: CXDDBHFLLPBKRS-OVYULKEKSA-N

Properties

• Density: 1.386g/cm³ (Cal.)
• Boiling point: 756.25°C at 760 mmHg (Cal.)
• Flash point: 411.165°C (Cal.)