Name: Fredericamycin A
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219599971
Cas No:80455-68-1
常用名:Fredericamycin A
IUPAC:(2S)-4,9,9'-trihydroxy-6-methoxy-3'-[(1E,3E)-penta-1,3-dien-1-yl]-1,1',2',3,5,6',7',8-octahydrospiro[cyclopenta[b]naphthalene-2,8'-cyclopenta[g]isoquinoline]-1,1',3,5,8-pentone
IUPAC:(2S)-4,9,9'-trihydroxy-6-methoxy-3'-[(1E,3E)-penta-1,3-dien-1-yl]-1,1',2',3,5,6',7',8-octahydrospiro[cyclopenta[b]naphthalene-2,8'-cyclopenta[g]isoquinoline]-1,1',3,5,8-pentone
InChI key:BZONSJUONOFNNP-MHSJTTIKSA-N

分子式:C30H21NO9
分子量:539.496
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COC1=CC(=O)c2c(O)c3C(=O)[C@@]4(CCc5cc6cc(\C=C\C=C\C)[nH]c(=O)c6c(O)c45)C(=O)c3c(O)c2C1=O
SMILES:COC1=CC(=O)c2c(O)c3C(=O)[C@@]4(CCc5cc6cc(\C=C\C=C\C)[nH]c(=O)c6c(O)c45)C(=O)c3c(O)c2C1=O

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