Name: Aconicarchamine B
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT220769471
Cas No:
常用名:Aconicarchamine B
IUPAC:[(1R,2S,5R,8R,9R,10S,11R,12R,13S,14R,15R)-11-(acetyloxy)-7-ethyl-2,12,14-trihydroxy-5-methyl-7-azahexacyclo[7.6.2.2^{10,13}.0^{1,8}.0^{5,16}.0^{10,15}]nonadecan-12-yl]methyl benzoate
IUPAC:[(1R,2S,5R,8R,9R,10S,11R,12R,13S,14R,15R)-11-(acetyloxy)-7-ethyl-2,12,14-trihydroxy-5-methyl-7-azahexacyclo[7.6.2.2^{10,13}.0^{1,8}.0^{5,16}.0^{10,15}]nonadecan-12-yl]methyl benzoate
InChI key:InChIKey=ULBZQAKXAOVAMY-NMKHAFIOSA-N

分子式:C31H41NO7
分子量:539.669
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12CC3([H])[C@@]4([C@@H](O)CC[C@@]3(C)CN(CC)[C@]14[H])[C@]1([H])[C@@H](O)[C@]3([H])CC[C@]21[C@@H](OC(C)=O)[C@]3(O)COC(=O)c1ccccc1
SMILES:[H][C@]12CC3([H])[C@@]4([C@@H](O)CC[C@@]3(C)CN(CC)[C@]14[H])[C@]1([H])[C@@H](O)[C@]3([H])CC[C@]21[C@@H](OC(C)=O)[C@]3(O)COC(=O)c1ccccc1

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