Name: Methyl 1,4-bisglucosyloxy-3-prenyl-2-naphthoate
Rating: 5 (10 reviews)

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HIT ID:HIT212665688
Cas No:90685-26-0
常用名:Methyl 1,4-bisglucosyloxy-3-prenyl-2-naphthoate
常用名:Methyl 1,4-bisglucosyloxy-3-prenyl-2-naphthoate
IUPAC:methyl 3-(3-methylbut-2-en-1-yl)-1,4-bis({[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})naphthalene-2-carboxylate
IUPAC:methyl 3-(3-methylbut-2-en-1-yl)-1,4-bis({[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})naphthalene-2-carboxylate
InChI key:OZDABLANSWPSGY-GIQZDESDSA-N

分子式:C29H38O14
分子量:610.609
氢键供体数 (HBD):8
氢键受体数 (HBA):13
LogP:-0.4485003
SMILES:[#6]-[#8]-[#6](=O)-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8]-[#6@@H]-2-[#8]-[#6@H](-[#6]-[#8])-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-2-[#8])c2ccccc2c1-[#8]-[#6@@H]-1-[#8]-[#6@H](-[#6]-[#8])-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-1-[#8]
SMILES:[#6]-[#8]-[#6](=O)-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8]-[#6@@H]-2-[#8]-[#6@H](-[#6]-[#8])-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-2-[#8])c2ccccc2c1-[#8]-[#6@@H]-1-[#8]-[#6@H](-[#6]-[#8])-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-1-[#8]

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