Name: Mckeanianone B
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214311664
Cas No:2035475-14-8
常用名:Mckeanianone B
IUPAC:5,8,9-trihydroxy-7,10-bis[(2Z)-4-hydroxy-3-methylbut-2-en-1-yl]-2-methyl-2-[({5,8,9-trihydroxy-7,10-bis[(2Z)-4-hydroxy-3-methylbut-2-en-1-yl]-2,2-dimethyl-2,6-dihydro-1,11-dioxatetracen-6-ylidene}-lambda3-oxy)methyl]-2,6-dihydro-1,11-dioxatetracen-6-one
IUPAC:5,8,9-trihydroxy-7,10-bis[(2Z)-4-hydroxy-3-methylbut-2-en-1-yl]-2-methyl-2-[({5,8,9-trihydroxy-7,10-bis[(2Z)-4-hydroxy-3-methylbut-2-en-1-yl]-2,2-dimethyl-2,6-dihydro-1,11-dioxatetracen-6-ylidene}-lambda3-oxy)methyl]-2,6-dihydro-1,11-dioxatetracen-6-one
InChI key:LFDICJDACDNKBL-TXZSXUPKSA-N

分子式:C56H59O16
分子量:988.072
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C\C(CO)=C\Cc1c(O)c(O)c(C\C=C(\C)CO)c2c1oc1cc3OC(C)(C[O]=c4c5c(O)c6C=CC(C)(C)Oc6cc5oc5c(C\C=C(\C)CO)c(O)c(O)c(C\C=C(\C)CO)c45)C=Cc3c(O)c1c2=O |w:28.28,c:35,69|
SMILES:C\C(CO)=C\Cc1c(O)c(O)c(C\C=C(\C)CO)c2c1oc1cc3OC(C)(C[O]=c4c5c(O)c6C=CC(C)(C)Oc6cc5oc5c(C\C=C(\C)CO)c(O)c(O)c(C\C=C(\C)CO)c45)C=Cc3c(O)c1c2=O |w:28.28,c:35,69|

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