Name: Scutebata E
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214316176
Cas No:1207181-61-0
常用名:Scutebata E
IUPAC:(3S,4aR,5S,6R,6aR,10R,10aS,10bR)-5,6-bis(acetyloxy)-4a,6a,7,10b-tetramethyl-5'-oxo-1,2,4a,5,6,6a,9,10,10a,10b-decahydrospiro[naphtho[2,1-b]pyran-3,3'-oxolan]-10-yl 2-methylpropanoate
IUPAC:(3S,4aR,5S,6R,6aR,10R,10aS,10bR)-5,6-bis(acetyloxy)-4a,6a,7,10b-tetramethyl-5'-oxo-1,2,4a,5,6,6a,9,10,10a,10b-decahydrospiro[naphtho[2,1-b]pyran-3,3'-oxolan]-10-yl 2-methylpropanoate
InChI key:HGPSPRNFABBWFI-URBRYQCVSA-N

分子式:C28H40O9
分子量:520.619
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12[C@@H](CC=C(C)[C@]1(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@]1(C)O[C@@]3(COC(=O)C3)CC[C@]21C)OC(=O)C(C)C |t:4|
SMILES:[H][C@]12[C@@H](CC=C(C)[C@]1(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@]1(C)O[C@@]3(COC(=O)C3)CC[C@]21C)OC(=O)C(C)C |t:4|

Scutebata E shows weak cytotoxicity with IC50 values ranging from 35.11 to 42.73 μM against K562 cell lines.

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