Name: Epirengynic acid
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT213511178
Cas No:1310146-00-9;517883-38-4
常用名:Epirengynic acid
IUPAC:2-[(1r,4r)-1,4-dihydroxycyclohexyl]acetic acid
IUPAC:2-[(1r,4r)-1,4-dihydroxycyclohexyl]acetic acid
InChI key:LHDVONJKFJRQTI-FKQCQYRASA-N

分子式:C8H14O4
分子量:174.196
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]1(O)CC[C@@](O)(CC(O)=O)CC1 |wU:1.1,5.6,wD:1.0,5.5,(2.67,3.08,;1.33,2.31,;1.33,3.85,;2.67,1.54,;2.67,,;1.33,-.77,;2.32,-1.95,;.34,-1.95,;-1.17,-1.68,;-1.7,-.24,;-2.16,-2.86,;;,1.54,)|
SMILES:[H][C@]1(O)CC[C@@](O)(CC(O)=O)CC1 |wU:1.1,5.6,wD:1.0,5.5,(2.67,3.08,;1.33,2.31,;1.33,3.85,;2.67,1.54,;2.67,,;1.33,-.77,;2.32,-1.95,;.34,-1.95,;-1.17,-1.68,;-1.7,-.24,;-2.16,-2.86,;;,1.54,)|

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