Name: Otophylloside F
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214316083
Cas No:250217-73-3
常用名:Otophylloside F
IUPAC:(1S,3aR,3bS,7S,9aR,9bR,11R,11aS)-1-acetyl-1,3a,3b-trihydroxy-7-{[(2R,4S,5S,6R)-4-hydroxy-5-{[(2S,4S,5R,6R)-5-{[(2S,4R,5R,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl]oxy}-6-methyloxan-2-yl]oxy}-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-11-yl 3,4-dimethylpent-2-enoate
IUPAC:(1S,3aR,3bS,7S,9aR,9bR,11R,11aS)-1-acetyl-1,3a,3b-trihydroxy-7-{[(2R,4S,5S,6R)-4-hydroxy-5-{[(2S,4S,5R,6R)-5-{[(2S,4R,5R,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl]oxy}-6-methyloxan-2-yl]oxy}-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-11-yl 3,4-dimethylpent-2-enoate
InChI key:WUXHIIZZAYEGCQ-MCSBQNIISA-N

分子式:C48H76O16
分子量:909.12
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12C[C@@H](OC(=O)C=C(C)C(C)C)[C@]3(C)[C@@](O)(CC[C@]3(O)[C@]1(O)CC=C1C[C@H](CC[C@]21C)O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@H](OC)[C@H](O[C@H]3C[C@@H](OC)[C@H](O)[C@@H](C)O3)[C@@H](C)O2)[C@@H](C)O1)C(C)=O |w:7.6,t:26|
SMILES:[H][C@]12C[C@@H](OC(=O)C=C(C)C(C)C)[C@]3(C)[C@@](O)(CC[C@]3(O)[C@]1(O)CC=C1C[C@H](CC[C@]21C)O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@H](OC)[C@H](O[C@H]3C[C@@H](OC)[C@H](O)[C@@H](C)O3)[C@@H](C)O2)[C@@H](C)O1)C(C)=O |w:7.6,t:26|

Otophylloside F can suppress the seizure-like locomotor activity caused by pentylenetetrazole in zebrafish.

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