31100-06-8 (Resveratrol,Resveratrol)

CAS号:
31100-06-8
中文名称:
Resveratrol
英文名称:
Resveratrol
分子式:
C14H12O3
分子量:
228.2433

Resveratrol(31100-06-8)名称与标识符

名称

英文别名:
resveratrol;trans-resveratrol;3,4',5-Trihydroxystilbene;3,5,4'-Trihydroxystilbene;(E)-resveratrol;3,4',5-Stilbenetriol;(E)-5-(4-Hydroxystyryl)benzene-1,3-diol;5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol;Resvida;3,4',5-Trihydroxy-trans-stilbene;SRT501;5-[(1E)-2-(4-Hydroxyphenyl)ethenyl]-1,3-benzenediol;3,5,4'-Trihydroxy-trans-stilbene;Resveratol;trans-3,4',5-trihydroxystilbene;5-[(E)-2-(4-hydroxyphenyl)vinyl]benzene-1,3-diol;Resveratrol, natural;

标识符

InChIKey:
LUKBXSAWLPMMSZ-OWOJBTEDSA-N
Inchi:
1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+
SMILES:
O([H])C1C([H])=C(C([H])=C(C=1[H])/C(/[H])=C(\[H])/C1C([H])=C([H])C(=C([H])C=1[H])O[H])O[H]

Resveratrol(31100-06-8)物化性质

计算特性

  • 氢键供体数量 : 3
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 2
  • 重原子数量 : 17
  • 复杂度 : 246
  • 拓扑分子极性表面积 : 60.7