Name: Meliponamycin A
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218848466
Cas No:2954772-55-3
常用名:Meliponamycin A
IUPAC:(2S)-N-[(4aR,10S,20S)-6-hydroxy-9,10,15-trimethyl-5,8,11,14,17,21-hexaoxo-19-(propan-2-yl)-icosahydro-1H-pyridazino[3,2-o]1-oxa-4,7,10,13,16-pentaazacyclononadecan-20-yl]-2-[(2R,5R,6R)-6-ethyl-2-hydroxy-5-(2-methylpropyl)oxan-2-yl]-2-hydroxypropanamide
IUPAC:(2S)-N-[(4aR,10S,20S)-6-hydroxy-9,10,15-trimethyl-5,8,11,14,17,21-hexaoxo-19-(propan-2-yl)-icosahydro-1H-pyridazino[3,2-o]1-oxa-4,7,10,13,16-pentaazacyclononadecan-20-yl]-2-[(2R,5R,6R)-6-ethyl-2-hydroxy-5-(2-methylpropyl)oxan-2-yl]-2-hydroxypropanamide
InChI key:ZUADRGNPCRMAFH-CMEYIMQZSA-N

分子式:C36H61N7O12
分子量:783.921
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12CCCNN1C(=O)[C@@H](NC(=O)[C@@](C)(O)[C@@]1(O)CC[C@H](CC(C)C)[C@@H](CC)O1)C(OC(=O)CN(C)C(=O)CNC(=O)[C@H](C)N(C)C(=O)CN(O)C2=O)C(C)C
SMILES:[H][C@]12CCCNN1C(=O)[C@@H](NC(=O)[C@@](C)(O)[C@@]1(O)CC[C@H](CC(C)C)[C@@H](CC)O1)C(OC(=O)CN(C)C(=O)CNC(=O)[C@H](C)N(C)C(=O)CN(O)C2=O)C(C)C

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