Name: Picraline
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214316118
Cas No:2671-32-1
常用名:Picraline
IUPAC:methyl (1R,9S,11S,14E,15S,17S)-19-[(acetyloxy)methyl]-14-ethylidene-18-oxa-2,12-diazahexacyclo[9.6.1.1^{9,15}.0^{1,9}.0^{3,8}.0^{12,17}]nonadeca-3(8),4,6-triene-19-carboxylate
IUPAC:methyl (1R,9S,11S,14E,15S,17S)-19-[(acetyloxy)methyl]-14-ethylidene-18-oxa-2,12-diazahexacyclo[9.6.1.1^{9,15}.0^{1,9}.0^{3,8}.0^{12,17}]nonadeca-3(8),4,6-triene-19-carboxylate
InChI key:DXTJMQCRVFWNBD-ATDXHQETSA-N

分子式:C23H26N2O5
分子量:410.47
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12C[C@@]34c5ccccc5N[C@]3(O1)[C@]1([H])C[C@@]([H])(\C(CN21)=C/C)C4(COC(C)=O)C(=O)OC
SMILES:[H][C@@]12C[C@@]34c5ccccc5N[C@]3(O1)[C@]1([H])C[C@@]([H])(\C(CN21)=C/C)C4(COC(C)=O)C(=O)OC

A series of a hydroxy substituted derivatives 21-28 at C-17 of the Picraline-type alkaloids have been derived as having potent SGLT inhibitory activity.

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