Name: Ampullosporin A
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

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HIT ID:HIT219251482
Cas No:197960-94-4
常用名:Ampullosporin A
IUPAC:(2S)-2-{2-[(2S)-2-[(2S)-4-carbamoyl-2-[2-(2-{2-[(2S)-4-carbamoyl-2-{2-[(2S)-2-(2-{2-[(2S)-2-[(2S)-2-acetamido-3-(1H-indol-3-yl)propanamido]propanamido]-2-methylpropanamido}-2-methylpropanamido)-4-methylpentanamido]-2-methylpropanamido}butanamido]-2-methylpropanamido}-2-methylpropanamido)-2-methylpropanamido]butanamido]-4-methylpentanamido]-2-methylpropanamido}-N-[(2S)-1-hydroxy-4-methylpentan-2-yl]pentanediamide
IUPAC:(2S)-2-{2-[(2S)-2-[(2S)-4-carbamoyl-2-[2-(2-{2-[(2S)-4-carbamoyl-2-{2-[(2S)-2-(2-{2-[(2S)-2-[(2S)-2-acetamido-3-(1H-indol-3-yl)propanamido]propanamido]-2-methylpropanamido}-2-methylpropanamido)-4-methylpentanamido]-2-methylpropanamido}butanamido]-2-methylpropanamido}-2-methylpropanamido)-2-methylpropanamido]butanamido]-4-methylpentanamido]-2-methylpropanamido}-N-[(2S)-1-hydroxy-4-methylpentan-2-yl]pentanediamide
InChI key:QXMNSBVEOAGSSK-WWSPCDPFSA-N

分子式:C77H127N19O19
分子量:1622.977
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(C)C[C@@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O
SMILES:CC(C)C[C@@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O

Ampullosporin A 是一种从真菌Sepedonium ampullosporum HKI-0053中分离出的peptaibol型多肽，具有神经阻滞剂样作用。它能够抑制NMDA受体拮抗剂MK-801诱导的多动症，并改善亚慢性氯胺酮处理引起的社交行为异常。同时，Ampullosporin A 可以改变谷氨酸受体的活性，而对多巴胺D1和D2受体没有影响。

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