trivial
HU-308
systemic
[(1'R',2'R',5'R')-2-[2,6-Dimethoxy-4-(2-methyloctan-2-yl)phenyl]-7,7-dimethyl-4-bicyclo[3.1.1]hept-3-enyl]methanol
HU-308
systemic
[(1'R',2'R',5'R')-2-[2,6-Dimethoxy-4-(2-methyloctan-2-yl)phenyl]-7,7-dimethyl-4-bicyclo[3.1.1]hept-3-enyl]methanol
Identifiers
InChIKey: CFMRIVODIXTERW-FDFHNCONSA-N
Formula: C27H42O3
CAS Registry numbers:
256934-39-1
Descriptors
Bioavailability-related
Molecular weight: 414.31 DaPartition coefficient: 6.63
H bond donors: 1
H bond acceptors: 3
Rotatable bonds: 10
Molar refractivity: 124.62 J mol-1 K-1
Polar surface area: 38.69 Å2
Generic
Stereocenters: 3Heteroatoms: 3
Spiroatoms: 0
Bridge atoms: 2
Amide bonds: 0
Ring-related
Rings: 4Heterocycles: 0
Aromatic rings: 1
Aromatic carbocycles: 1
Aromatic heterocycles: 0
Aliphatic rings: 3
Aliphatic carbocycles: 3
Aliphatic heterocycles: 0