Name: Baumycin A1
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219600789
Cas No:64314-28-9
常用名:Baumycin A1
IUPAC:(8S,10S)-8-acetyl-10-{[(2R,4S,5S,6S)-4-amino-5-{3-hydroxy-1-[(1-hydroxypropan-2-yl)oxy]butoxy}-6-methyloxan-2-yl]oxy}-6,8,11-trihydroxy-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione
IUPAC:(8S,10S)-8-acetyl-10-{[(2R,4S,5S,6S)-4-amino-5-{3-hydroxy-1-[(1-hydroxypropan-2-yl)oxy]butoxy}-6-methyloxan-2-yl]oxy}-6,8,11-trihydroxy-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione
InChI key:MWURQTZZKGQQIE-GRZLGHIZSA-N

分子式:C34H43NO13
分子量:673.712
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](OC(CC(C)O)OC(C)CO)[C@H](C)O5)c4c(O)c3C(=O)c12)C(C)=O
SMILES:COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](OC(CC(C)O)OC(C)CO)[C@H](C)O5)c4c(O)c3C(=O)c12)C(C)=O

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