Name: Citreoindole
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214321023
Cas No:138655-14-8
常用名:Citreoindole
IUPAC:(3S,6S)-3-{[(2S,10R,10aR)-10-hydroxy-4-oxo-2-phenyl-1H,2H,3H,4H,10H,10aH-pyrimido[1,2-a]indol-10-yl]methyl}-6-benzylpiperazine-2,5-dione
IUPAC:(3S,6S)-3-{[(2S,10R,10aR)-10-hydroxy-4-oxo-2-phenyl-1H,2H,3H,4H,10H,10aH-pyrimido[1,2-a]indol-10-yl]methyl}-6-benzylpiperazine-2,5-dione
InChI key:PDYXWTDVSYEDKW-DQKFTCOISA-N

分子式:C29H28N4O4
分子量:496.567
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12N[C@@H](CC(=O)N1c1ccccc1[C@]2(O)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC1=O)c1ccccc1
SMILES:[H][C@@]12N[C@@H](CC(=O)N1c1ccccc1[C@]2(O)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC1=O)c1ccccc1

Citreoindole is a diketopiperazine metabolite isolated from a hybrid cell fusion of two strains of P. citreovirde that is cytotoxic in vitro against HeLa cells at 8.4 μM.

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