名称: 1-[(3,4-Dimethoxy-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydro-naphthalen-2-yl]-phenyl-acetic acid
SMILES:
COc1ccc(CC2c3cc(OC)c(OC)cc3CCC2C2(CC(=O)O)C=CC=CC2)cc1OCMolecular Processing
Molecular formula
C29H34O6
Molecular weight
478.59
Exact mass
478.2355
XLogP
5.59
TPSA
74.22
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
35
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.414
Molar refractivity
134.93
Supplementary Information
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