Name: Adynerin
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT213334281
Cas No:35109-93-4
常用名:Adynerin
别名:欧夹竹桃苷乙
IUPAC:4-[(1S,3R,6R,7R,10R,11S,14S,16R)-14-{[(2R,4R,5S,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-7,11-dimethyl-2-oxapentacyclo[8.8.0.0^{1,3}.0^{3,7}.0^{11,16}]octadecan-6-yl]-2,5-dihydrofuran-2-one
IUPAC:4-[(1S,3R,6R,7R,10R,11S,14S,16R)-14-{[(2R,4R,5S,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-7,11-dimethyl-2-oxapentacyclo[8.8.0.0^{1,3}.0^{3,7}.0^{11,16}]octadecan-6-yl]-2,5-dihydrofuran-2-one
InChI key:BYZQVAOKDQTHHP-QFUJVLJYSA-N

分子式:C30H44O7
分子量:516.675
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]1(C[C@@H](OC)[C@@H](O)[C@@H](C)O1)O[C@H]1CC[C@@]2(C)[C@]([H])(CC[C@@]34O[C@@]33CC[C@H](C5=CC(=O)OC5)[C@@]3(C)CC[C@]24[H])C1 |t:29|
SMILES:[H][C@@]1(C[C@@H](OC)[C@@H](O)[C@@H](C)O1)O[C@H]1CC[C@@]2(C)[C@]([H])(CC[C@@]34O[C@@]33CC[C@H](C5=CC(=O)OC5)[C@@]3(C)CC[C@]24[H])C1 |t:29|

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