methyl (1S,4aS,7R,7aS)-5'-oxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4'-[(1S)-1-[(E)-3-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoyl]oxyethyl]spiro[4a,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-furan]-4-carboxylate

methyl (1S,4aS,7R,7aS)-5'-oxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4'-[(1S)-1-[(E)-3-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoyl]oxyethyl]spiro[4a,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-furan]-4-carboxylate 基本信息
CAS号 80396-57-2 分子式 C36H42O19
分子量 778.70700 精确质量  778.23200
PSA  286.89000 LogP  -2.93590

等价的CAS号:

80396-57-2,86333-77-9,87508-80-3

基本信息 展开↓

CAS号:
80396-57-2
3D弹球模型:
立即前往扯扯看
分子式:
C36H42O19
分子量:
778.70700
英文名称:
methyl (1S,4aS,7R,7aS)-5'-oxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4'-[(1S)-1-[(E)-3-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoyl]oxyethyl]spiro[4a,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-furan]-4-carboxylate
英文别名:
methyl (1S,4aS,7R,7aS)-5'-oxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4'-[(1S)-1-[(E)-3-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoyl]oxyethyl]spiro[4a,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-furan]-4-carboxylate;
Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]- 4-carboxylic acid,1-(â-D-glucopyranosyloxy)- 4'-[1-[[3-[4-(â-D-glucopyranosyloxy)phenyl]- 1-oxo-2-propenyl]oxy]ethyl]-4a,7a-dihydro- 5'-oxo-,methyl ester,[1S-[1R,4aR,7R[R*(E)],7aR]]-
精确分子量/精确质量:
778.23200
极性分子表面积/PSA:
286.89000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: AFYIWKNGSIYXCQ-WLJLAZGQSA-N

物化性质展开↓

密度:
1.62g/cm3
沸点:
1040.3ºC at 760 mmHg
闪点:
322.5ºC
折射率:
1.677

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