trivial
Trendione
ESTRA-4,9,11-TRIENE-3,17-DIONE
systemic
(8'S',13'S',14'S')-13-Methyl-1,2,6,7,8,14,15,16-octahydrocyclopenta['a']phenanthrene-3,17-dione
Trendione
ESTRA-4,9,11-TRIENE-3,17-DIONE
systemic
(8'S',13'S',14'S')-13-Methyl-1,2,6,7,8,14,15,16-octahydrocyclopenta['a']phenanthrene-3,17-dione
Identifiers
InChIKey: KBSXJBBFQODDTQ-RYRKJORJSA-N
Formula: C18H20O2
CAS Registry numbers:
4642-95-9
Descriptors
Bioavailability-related
Molecular weight: 268.15 DaPartition coefficient: 3.54
H bond donors: 0
H bond acceptors: 2
Rotatable bonds: 0
Molar refractivity: 77.05 J mol-1 K-1
Polar surface area: 34.14 Å2
Generic
Stereocenters: 3Heteroatoms: 2
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 0
Ring-related
Rings: 4Heterocycles: 0
Aromatic rings: 0
Aromatic carbocycles: 0
Aromatic heterocycles: 0
Aliphatic rings: 4
Aliphatic carbocycles: 4
Aliphatic heterocycles: 0