89253-99-6 (L-聚伞花序,L-cymarose)

快速询单

结构式：

L-聚伞花序MOL文件

CAS号：

89253-99-6

中文名称：

L-聚伞花序

英文名称：

L-cymarose

分子式：

C₇H₁₄O₄

分子量：

162.183662891388

L-聚伞花序(89253-99-6)名称与标识符

名称

英文别名：

L-cymarose;L-Diginose;L-diginose (2,6-dideoxy-3-O-methyl-lyxo-hexose);L-Diginose (3-O-Methyl-2.6-didesoxy-L-lyxohexose);O3-methyl-L-lyxo-2,6-dideoxy-hexose;2,6-Dideoxy-3-O-methyl-beta-D-ribo-hexopyranose;D-Cymarose;2,6-Dideoxy-3-O-methyl-beta-L-arabino-Hexopyranose;DTXSID30973490;AG-G-04688;beta-Cymaropyranose;(2R,4S,5R,6R)-4-methoxy-6-methyl-tetrahydropyran-2,5-diol;beta-D-Ribo-hexopyranose, 2,6-dideoxy-3-O-methyl-;C08234;CTK5A7612;UNII-74VS19SL1M;SureCN182615;74VS19SL1M;SCHEMBL182615;DBDJCJKVEBFXHG-XZBKPIIZSA-N;beta-D-Cymarose pyranose;.BETA.-D-CYMAROSE PYRANOSE;2,6-dideoxy-3-o-methylhexopyranose;.BETA.-D-RIBO-HEXOPYRANOSE, 2,6-DIDEOXY-3-O-METHYL-;AC1L9B4J;89253-99-6;2,6-DIDEOXY-3-O-METHYL-.BETA.-D-RIBO-HEXOPYRANOSE;(2R,4S,5R,6R)-4-methoxy-6-methyloxane-2,5-diol;

标识符

InChIKey：

DBDJCJKVEBFXHG-XZBKPIIZSA-N

Inchi：

1S/C7H14O4/c1-4-7(9)5(10-2)3-6(8)11-4/h4-9H,3H2,1-2H3/t4-,5+,6-,7-/m1/s1

SMILES：

O1[C@H](C[C@@H]([C@@H]([C@H]1C)O)OC)O

L-聚伞花序(89253-99-6)物化性质

计算特性

精确分子量 : 162.08920892g/mol
氢键供体数量 : 2
氢键受体数量 : 4
可旋转化学键数量 : 1
同位素质量 : 162.08920892g/mol
重原子数量 : 11
复杂度 : 128
同位素原子数量 : 0
确定原子立构中心数量 : 4
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : -0.6
拓扑分子极性表面积 : 58.9Å²

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