125184-93-2 (((11R)-dihydroartemisinic aldehyde)

CAS号:
125184-93-2
英文名称:
(11R)-dihydroartemisinic aldehyde
分子式:
C15H24O
分子量:
220.350464820862

(11R)-dihydroartemisinic aldehyde(125184-93-2)名称与标识符

名称

英文别名:
(11R)-dihydroartemisinic aldehyde;dihydroartemisinic aldehyde;dihydroartemisinyl aldehyde;(11R)-dihydroartemisic aldehyde;(2R)-2-[(1R,4R,4aS,8aS)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]propanal;C20325;Q27133381;(2R)-2-[[(1R)-4beta,7-Dimethyl-1,2,3,4,4abeta,5,6,8abeta-octahydronaphthalen]-1-yl]propanal;

标识符

InChIKey:
PIUSZJFEZXYOAT-QTVXIADOSA-N
Inchi:
1S/C15H24O/c1-10-4-6-13-11(2)5-7-14(12(3)9-16)15(13)8-10/h8-9,11-15H,4-7H2,1-3H3/t11-,12+,13+,14+,15+/m1/s1
SMILES:
O=C[C@H](C)[C@@H]1CC[C@@H](C)[C@@H]2CCC(C)=C[C@@H]21

(11R)-dihydroartemisinic aldehyde(125184-93-2)物化性质

计算特性

  • 氢键供体数量 : 0
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 2
  • 重原子数量 : 16
  • 复杂度 : 292
  • 疏水参数计算参考值(XlogP) : 3.8
  • 拓扑分子极性表面积 : 17.1

(11R)-dihydroartemisinic aldehyde(125184-93-2)相关文献