Name: Etamycin A
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219600307
Cas No:299-20-7
常用名:Etamycin A
IUPAC:N-[(6S,9S,12S,15R,16S,19R,23R,24aR)-23-hydroxy-2,5,9,11,15-pentamethyl-6-[(2S)-3-methylbutan-2-yl]-19-(2-methylpropyl)-1,4,7,10,13,17,20-heptaoxo-12-phenyl-docosahydro-1H-pyrrolo[2,1-o]1-oxa-4,7,10,13,16,19-hexaazacyclodocosan-16-yl]-3-hydroxypyridine-2-carboxamide
IUPAC:N-[(6S,9S,12S,15R,16S,19R,23R,24aR)-23-hydroxy-2,5,9,11,15-pentamethyl-6-[(2S)-3-methylbutan-2-yl]-19-(2-methylpropyl)-1,4,7,10,13,17,20-heptaoxo-12-phenyl-docosahydro-1H-pyrrolo[2,1-o]1-oxa-4,7,10,13,16,19-hexaazacyclodocosan-16-yl]-3-hydroxypyridine-2-carboxamide
InChI key:SATIISJKSAELDC-ZIOPZPSVSA-N

分子式:C44H62N8O11
分子量:879.025
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12C[C@@H](O)CN1C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ncccc1O)[C@@H](C)OC(=O)[C@@H](N(C)C(=O)[C@H](C)NC(=O)[C@]([H])([C@@H](C)C(C)C)N(C)C(=O)CN(C)C2=O)c1ccccc1
SMILES:[H][C@]12C[C@@H](O)CN1C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ncccc1O)[C@@H](C)OC(=O)[C@@H](N(C)C(=O)[C@H](C)NC(=O)[C@]([H])([C@@H](C)C(C)C)N(C)C(=O)CN(C)C2=O)c1ccccc1

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