الاسم: (13E)-(5RS,6RS,9α,11α,15S)-5-bromo-6,9-epoxy-11,15-dihydroxyprost-13-enoic acid 2-propoxyethyl ester
SMILES:
CCCCC[C@H](O)/C=C/[C@@H]1[C@H]2CC(C(Br)CCCC(=O)OCCOCCC)O[C@H]2C[C@H]1OMolecular Processing
Molecular formula
C25H43BrO6
Molecular weight
519.52
Exact mass
518.2243
XLogP
4.54
TPSA
85.22
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
16
Heavy atoms
32
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
7
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.88
Molar refractivity
128.81
Supplementary Information
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