Name: Teixobactin
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214317861
Cas No:1613225-53-8
常用名:Teixobactin
IUPAC:(2R)-N-[(1R,2S)-1-{[(1S,2S)-1-{[(1S)-1-{[(3S,6S,9S,12R,13S)-6-{[(5S)-2-amino-4,5-dihydro-1H-imidazol-5-yl]methyl}-3-[(2S)-butan-2-yl]-9,13-dimethyl-2,5,8,11-tetraoxo-1-oxa-4,7,10-triazacyclotridecan-12-yl]carbamoyl}-2-hydroxyethyl]carbamoyl}-2-methylbutyl]carbamoyl}-2-methylbutyl]-2-[(2S)-3-hydroxy-2-[(2S,3S)-3-methyl-2-[(2R)-2-(methylamino)-3-phenylpropanamido]pentanamido]propanamido]pentanediamide
IUPAC:(2R)-N-[(1R,2S)-1-{[(1S,2S)-1-{[(1S)-1-{[(3S,6S,9S,12R,13S)-6-{[(5S)-2-amino-4,5-dihydro-1H-imidazol-5-yl]methyl}-3-[(2S)-butan-2-yl]-9,13-dimethyl-2,5,8,11-tetraoxo-1-oxa-4,7,10-triazacyclotridecan-12-yl]carbamoyl}-2-hydroxyethyl]carbamoyl}-2-methylbutyl]carbamoyl}-2-methylbutyl]-2-[(2S)-3-hydroxy-2-[(2S,3S)-3-methyl-2-[(2R)-2-(methylamino)-3-phenylpropanamido]pentanamido]propanamido]pentanediamide
InChI key:LMBFAGIMSUYTBN-MPZNNTNKSA-N

分子式:C58H95N15O15
分子量:1242.488
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]1(NC(=O)[C@H](C[C@H]2CN=C(N)N2)NC(=O)[C@H](C)NC(=O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@H](C)OC1=O)[C@@H](C)CC |t:9|
SMILES:[H][C@]1(NC(=O)[C@H](C[C@H]2CN=C(N)N2)NC(=O)[C@H](C)NC(=O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@H](C)OC1=O)[C@@H](C)CC |t:9|

Teixobactin is a recently described antibiotic . It is a new class produced by a hitherto undescribed soil microorganism (provisionally named Eleftheria terrae).

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