Name: Dermaseptin-B9
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT217584822
Cas No:
常用名:Dermaseptin-B9
IUPAC:(4S)-4-{[(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-{2-[(2S,3S)-2-[(2S)-2-[(2S)-6-amino-2-{2-[(2S)-2-{2-[(2S)-6-amino-2-[(2S,3S)-2-[(2S,3S)-2-[(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]hexanamido]-3-hydroxybutanamido]-3-methylpentanamido]-3-methylpentanamido]hexanamido]acetamido}propanamido]acetamido}hexanamido]-4-(methylsulfanyl)butanamido]-3-methylpentanamido]acetamido}-3-hydroxypropanamido]-4-methylpentanamido]propanamido]hexanamido]-3-carbamoylpropanamido]-4-methylpentanamido]-4-methylpentanamido]acetamido}-3-hydroxypropanamido]-4-carbamoylbutanamido]propanamido]-4-carbamoylbutanoyl]pyrrolidin-2-yl]formamido}-4-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}butanoic acid
IUPAC:(4S)-4-{[(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-{2-[(2S,3S)-2-[(2S)-2-[(2S)-6-amino-2-{2-[(2S)-2-{2-[(2S)-6-amino-2-[(2S,3S)-2-[(2S,3S)-2-[(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]hexanamido]-3-hydroxybutanamido]-3-methylpentanamido]-3-methylpentanamido]hexanamido]acetamido}propanamido]acetamido}hexanamido]-4-(methylsulfanyl)butanamido]-3-methylpentanamido]acetamido}-3-hydroxypropanamido]-4-methylpentanamido]propanamido]hexanamido]-3-carbamoylpropanamido]-4-methylpentanamido]-4-methylpentanamido]acetamido}-3-hydroxypropanamido]-4-carbamoylbutanamido]propanamido]-4-carbamoylbutanoyl]pyrrolidin-2-yl]formamido}-4-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}butanoic acid
InChI key:XSOKLXHLFRPPPM-BEGOPPJJSA-N

分子式:C139H236N38O40S
分子量:3111.7
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CO)C(O)=O
SMILES:CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CO)C(O)=O

Dermaseptin-B9为Phyllomedusinae亚科青蛙分离得到的一种抗菌肽。

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供应商
TargetMolSC
规格
货期
纯度
-
待询
1

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