CC(C)=CCC[C@]1(C)C=Cc2c(O)c3c(c(CC=C(C)C)c2O1)O[C@]12C(C[C@@H]4C[C@H]1C(C)(C)O[C@@]2(C/C=C(/C)C(=O)O)C4=O)C3=O
SMILES: CC(C)=CCC[C@]1(C)C=Cc2c(O)c3c(c(CC=C(C)C)c2O1)O[C@]12C(C[C@@H]4C[C@H]1C(C)(C)O[C@@]2(C/C=C(/C)C(=O)O)C4=O)C3=O

Molecular Processing

Molecular formula
C38H46O8
Molecular weight
630.78
Exact mass
630.3193
XLogP
7.32
TPSA
119.36
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
46
Rings
7
Aromatic rings
1
Saturated rings
4
Aliphatic rings
6
Stereo centers
6
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.553
Molar refractivity
174.28

Supplementary Information

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