Name: 19-O-Acetylchaetoglobosin A
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214320689
Cas No:50939-69-0
常用名:19-O-Acetylchaetoglobosin A
IUPAC:(1R,3E,6R,7Z,9S,11E,13R,14S,16R,17S,18R,19S)-19-[(1H-indol-3-yl)methyl]-7,9,16,17-tetramethyl-2,5,21-trioxo-15-oxa-20-azatetracyclo[11.8.0.0^{1,18}.0^{14,16}]henicosa-3,7,11-trien-6-yl acetate
IUPAC:(1R,3E,6R,7Z,9S,11E,13R,14S,16R,17S,18R,19S)-19-[(1H-indol-3-yl)methyl]-7,9,16,17-tetramethyl-2,5,21-trioxo-15-oxa-20-azatetracyclo[11.8.0.0^{1,18}.0^{14,16}]henicosa-3,7,11-trien-6-yl acetate
InChI key:AZLAYOMQTNEYFJ-PWPDRILLSA-N

分子式:C34H38N2O6
分子量:570.686
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12O[C@]1(C)[C@@H](C)[C@@]1([H])[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@]11C(=O)\C=C\C(=O)[C@H](OC(C)=O)\C(C)=C/[C@@H](C)C\C=C\[C@@]21[H] |c:40,t:30,45|
SMILES:[H][C@@]12O[C@]1(C)[C@@H](C)[C@@]1([H])[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@]11C(=O)\C=C\C(=O)[C@H](OC(C)=O)\C(C)=C/[C@@H](C)C\C=C\[C@@]21[H] |c:40,t:30,45|

19-O-Acetylchaetoglobosin A is a fungal metabolite originally isolated fromC. globosumthat has actin polymerization inhibitory and cytotoxic activities.1,2It inhibits actin polymerization in a cell-free assay when used at a concentration of 2 μM.219-O-Acetylchaetoglobosin A (3.2, 10, and 32 μg/ml) is cytotoxic to HeLa cervical cancer cells.1

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