C=C/C=C/[C@H](OC)[C@H](C)[C@@H](OC)[C@@H](C)C(=O)O
名称: (E)-(2R,3R,4S,5S)-3,5-dimethoxy-2,4-dimethyl-nona-6,8-dienoic acid
SMILES: C=C/C=C/[C@H](OC)[C@H](C)[C@@H](OC)[C@@H](C)C(=O)O

Molecular Processing

Molecular formula
C13H22O4
Molecular weight
242.31
Exact mass
242.1518
XLogP
2.12
TPSA
55.76
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
17
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
66.89

Supplementary Information

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