Name: Iso-isariin B
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218848336
Cas No:2326436-93-3
常用名:Iso-isariin B
IUPAC:(6S,9R,19S)-19-[(2S)-hexan-2-yl]-6-methyl-9-(2-methylpropyl)-3,12-bis(propan-2-yl)-1-oxa-4,7,10,13,16-pentaazacyclononadecane-2,5,8,11,14,17-hexone
IUPAC:(6S,9R,19S)-19-[(2S)-hexan-2-yl]-6-methyl-9-(2-methylpropyl)-3,12-bis(propan-2-yl)-1-oxa-4,7,10,13,16-pentaazacyclononadecane-2,5,8,11,14,17-hexone
InChI key:DSWZWPQYGALTJZ-XUGSVAECSA-N

分子式:C30H53N5O7
分子量:595.782
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]1(CC(=O)NCC(=O)NC(C(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NC(C(C)C)C(=O)O1)[C@@H](C)CCCC
SMILES:[H][C@]1(CC(=O)NCC(=O)NC(C(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NC(C(C)C)C(=O)O1)[C@@H](C)CCCC

Iso-isariin B, an analogue of cyclocarboxyphenate, is utilized in antifungal studies [1].

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