5-N-Acetylardeemin
[CAS# 148441-26-3]

Identification

• Name: 5-N-Acetylardeemin
• Synonyms: 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
• Molecular Formula: C₂₈H₂₈N₄O₃
• Molecular Weight: 468.55
• CAS Registry Number: 148441-26-3
• SMILES: [C@@]15([C@H](N4[C@@H](C1)C3=NC2=CC=CC=C2C(=O)N3[C@@H](C4=O)C)N(C6=C5C=CC=C6)C(=O)C)C(C=C)(C)C
• InChI: 1S/C28H28N4O3/c1-6-27(4,5)28-15-22-23-29-20-13-9-7-11-18(20)25(35)30(23)16(2)24(34)32(22)26(28)31(17(3)33)21-14-10-8-12-19(21)28/h6-14,16,22,26H,1,15H2,2-5H3/t16-,22+,26+,28-/m1/s1
• InChIKey: XTLQWSBGQKPGCF-YWDSKPHESA-N

Properties

• Density: 1.35g/cm³ (Cal.)
• Boiling point: 701.401°C at 760 mmHg (Cal.)
• Flash point: 377.994°C (Cal.)