C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O.C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O
SMILES: C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O.C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O

Molecular Processing

Molecular formula
C37H52O4
Molecular weight
560.82
Exact mass
560.3866
XLogP
7.49
TPSA
77.76
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
41
Rings
8
Aromatic rings
1
Saturated rings
5
Aliphatic rings
7
Stereo centers
11
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.757
Molar refractivity
161.45

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→