CAS 93413-04-8

(7S)-6,7-Dihydro-7-[[(2S,9S,9aS)-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

Description:

The chemical substance known as (7S)-6,7-Dihydro-7-[[(2S,9S,9aS)-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, with the CAS number 93413-04-8, is a complex organic compound characterized by its multi-ring structure, which includes elements of both benzodiazepine and quinazoline frameworks. This compound features multiple stereocenters, indicating chirality, which can significantly influence its biological activity and pharmacological properties. It is likely to exhibit interactions with various biological targets, potentially including receptors or enzymes, due to its intricate structure. The presence of functional groups such as hydroxyl and carbonyl moieties suggests it may participate in hydrogen bonding and other intermolecular interactions. As a member of the benzodiazepine class, it may possess sedative, anxiolytic, or anticonvulsant properties, although specific biological activities would require empirical investigation. Overall, this compound represents a significant area of interest in medicinal chemistry and pharmacology.

Formula: C₃₁H₂₉N₅O₄

InChI: InChI=1/C31H29N5O4/c1-17(2)15-22-29(39)36-25-14-8-5-11-20(25)31(40,30(36)34-22)16-23-26-32-21-12-6-3-9-18(21)28(38)35(26)24-13-7-4-10-19(24)27(37)33-23/h3-14,17,22-23,30,34,40H,15-16H2,1-2H3,(H,33,37)/t22-,23-,30-,31-/m0/s1

InChI key: InChIKey=MGMRIOLWEROPJY-FPACPZPDSA-N

SMILES: C([C@@]1(O)[C@@]2(N(C=3C1=CC=CC3)C(=O)[C@H](CC(C)C)N2)[H])[C@H]4C=5N(C=6C(C(=O)N4)=CC=CC6)C(=O)C=7C(N5)=CC=CC7

Synonyms:

• [2S-[2a,9b,9(R*),9ab]]-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
• (7S)-6,7-Dihydro-7-[[(2S,9S,9aS)-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
• Asperlicin
• 93413-04-8
• 1H-Imidazo[1,2-a]indole, quinazolino[3,2-a][1,4]benzodiazepine-5,13-dione deriv.
• 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-[2α,9β,9(R*),9aβ]]-
• Quinazolino[3,2-a][1,4]benzodiazepine-5,13-dione, 6,7-dihydro-7-[[(2S,9S,9aS)-2,3,9,9a-tetrahydro-9-hydroxy-2-(2-methylpropyl)-3-oxo-1H-imidazo[1,2-a]indol-9-yl]methyl]-, (7S)-
• (7S)-6,7-Dihydro-7-[[(2S)-2β-(2-methylpropyl)-2,3,9,9aα-tetrahydro-3-oxo-9α-hydroxy-1H-imidazo[1,2-a]indole-9-yl]methyl]quinazolino[3,2-a][1,4]benzodiazepine-5,13-dione
• [7S,(-)]-6,7-Dihydro-7-[[(2S)-2,3,9,9aα-tetrahydro-9α-hydroxy-2β-(2-methylpropyl)-3-oxo-1H-imidazo[1,2-a]indole-9-yl]methyl]quinazolino[3,2-a][1,4]benzodiazepine-5,13-dione

Asperlicin

CAS: 93413-04-8

Asperlicin is a cholecystokinin (CCK) antagonist that can be found in Aspergillus alliaceus.

Formula: C₃₁H₂₉N₅O₄

Color and Shape: Solid

Molecular weight: 535.593

Ref: TM-TN9086