SMILES:
CCCc1c(OCCCOc2ccc3c(c2CCC)OC(C)(CCC(=O)O)CC3=O)ccc(C(C)=O)c1OMolecular Processing
Molecular formula
C30H38O8
Molecular weight
526.63
Exact mass
526.2567
XLogP
5.94
TPSA
119.36
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
14
Heavy atoms
38
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
143
Supplementary Information
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