Name: Aspochalasin D
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214321665
Cas No:71968-02-0
常用名:Aspochalasin D
IUPAC:(3S,3aR,4S,6aS,11R,12S,15aS)-11,12-dihydroxy-4,5,8-trimethyl-3-(2-methylpropyl)-1H,2H,3H,3aH,4H,6aH,9H,10H,11H,12H,15H-cycloundeca[d]isoindole-1,15-dione
IUPAC:(3S,3aR,4S,6aS,11R,12S,15aS)-11,12-dihydroxy-4,5,8-trimethyl-3-(2-methylpropyl)-1H,2H,3H,3aH,4H,6aH,9H,10H,11H,12H,15H-cycloundeca[d]isoindole-1,15-dione
InChI key:GCIKKGSNXSCKCP-WBEGXGIOSA-N

分子式:C24H35NO4
分子量:401.547
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12[C@H](CC(C)C)NC(=O)[C@]11C(=O)\C=C\[C@H](O)[C@H](O)CC\C(C)=C\[C@@]1([H])C=C(C)[C@H]2C |t:14,23,28|
SMILES:[H][C@]12[C@H](CC(C)C)NC(=O)[C@]11C(=O)\C=C\[C@H](O)[C@H](O)CC\C(C)=C\[C@@]1([H])C=C(C)[C@H]2C |t:14,23,28|

Aspochalasin D is a co-metabolite originally isolated from A. microcysticus with aspochalasins A, B, and C, that was initially thought to be inactive. It has antibacterial activity against Gram-positive and Gram-negative bacteria at a concentration of 1 mg/ml. Aspochalasin D is more cytotoxic, via apoptosis, to Ba/F3-V12 cells in an IL-3-free medium than in an IL-3-containing medium (IC50s = 0.49 and 1.9 μg/ml, respectively).

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