35688-46-1 (D-松醇,D-pinitol)

结构式:
CAS号:
35688-46-1
中文名称:
D-松醇
英文名称:
D-pinitol
分子式:
C7H14O6
分子量:
194.182463169098

D-松醇(35688-46-1)名称与标识符

名称

英文别名:
D-pinitol;Lucidol;Sequoyit;Sequoyitol (5-O-Methyl-myo-inosit);5D-5-O-Methyl-chiro-inositol;(1S,2R,3R,4R,5S,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol;5-O-Methyl-myo-inositol;1D-5-O-methyl-myo-inositol;(-)-bornesitol;Inositol, 2-O-methyl-, L-chiro-;1D-3-O-Methyl-myo-inositol;23887-12-9;1D-4-O-Methyl-myo-inositol;bornesitol;3-O-Methyl-myo-inositol;1D-(1,2,4/3,5,6)-5-O-methylcyclohexanehexol;Quebrachit;Quebrachitol, (-)-;Sennitol;4-O-Methyl-myo-inositol;D-1-O-Methyl-muco-inositol;Quebrachitol;L-chiro-Inositol, 2-O-methyl-;Matezitol;MLS002639102;1D-5-O-methyl-chiro-inositol;1D-1-O-methyl-myo-inositol;ConMedNP.274;ConMedNP.275;(1R,2S,3S,4S,5S,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol;D-(+)-pinitol;(-)-Quebrachitol;(1R,2S,3R,4S,5S,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol;D-Ononitol;D-(-)-bornesitol;(+)-pinitol;MLSMR;L- Bornesitol;SMR001548553;1-O-Methyl-myo-inositol;1D-2-O-methyl-chiro-inositol;1D-3-O-Methyl-chiro-inositol;Pinitol;(+)-quebrachitol;(1S,2R,3R,4S,5S,6R)-6-methoxycyclohexane-1,2,3,4,5-pentol;(1R,2S,3r,4R,5S,6r)-6-methoxycyclohexane-1,2,3,4,5-pentol;Ononitol;Pinit;Sequoyitol;L-Quebrachitol;(1R,2R,3S,4S,5R,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol;

标识符

InChIKey:
DSCFFEYYQKSRSV-UHFFFAOYSA-N
Inchi:
1S/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3
SMILES:
OC1C(O)C(O)C(OC)C(O)C1O

D-松醇(35688-46-1)物化性质

计算特性

  • 氢键供体数量 : 5
  • 氢键受体数量 : 6
  • 重原子数量 : 13
  • 疏水参数计算参考值(XlogP) : -1.797