4-Hydroxy-6-methyl-3-methylidene-2-oxo-3a,4,7,8,11,11a-hexahydrocyclodeca[b]furan-10-carbaldehyde的二维分子结构

4-Hydroxy-6-methyl-3-methylidene-2-oxo-3a,4,7,8,11,11a-hexahydrocyclodeca[b]furan-10-carbaldehyde

4-Hydroxy-6-methyl-3-methylidene-2-oxo-3a,4,7,8,11,11a-hexahydrocyclodeca[b]furan-10-carbaldehyde · CAS 73675-60-2

中文名
暂无
中文别名
暂无
英文名
4-Hydroxy-6-methyl-3-methylidene-2-oxo-3a,4,7,8,11,11a-hexahydrocyclodeca[b]furan-10-carbaldehyde
CAS
73675-60-2
CID
100207
IUPAC 名称
4-hydroxy-6-methyl-3-methylidene-2-oxo-3a,4,7,8,11,11a-hexahydrocyclodeca[b]furan-10-carbaldehyde

名称与编号

中文名
暂无
中文别名
暂无
英文名
4-Hydroxy-6-methyl-3-methylidene-2-oxo-3a,4,7,8,11,11a-hexahydrocyclodeca[b]furan-10-carbaldehyde
CAS
73675-60-2
CID
100207
IUPAC 名称
4-hydroxy-6-methyl-3-methylidene-2-oxo-3a,4,7,8,11,11a-hexahydrocyclodeca[b]furan-10-carbaldehyde

分子属性

分子式
C15H18O4
分子量
262.3 g/mol
精确质量
262.12050905 Da
单同位素质量
262.12050905 Da
XLogP
1.1
极性表面积
63.6 Ų
氢键供体
1
氢键受体
4
可旋转键
1
重原子数
19
净电荷
0
结构复杂度
473

结构标识

InChIKey
AIWBJIOCQDWGGI-UHFFFAOYSA-N
SMILES
CC1=CC(C2C(CC(=CCC1)C=O)OC(=O)C2=C)O
InChI
InChI=1S/C15H18O4/c1-9-4-3-5-11(8-16)7-13-14(12(17)6-9)10(2)15(18)19-13/h5-6,8,12-14,17H,2-4,7H2,1H3

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