MetaADEDB 2.0 @ LMMD
beta-funaltrexamine
(PQKHESYTSKMWFP-WZJCLRDWSA-N)
Structure
SMILES
COC(=O)/C=C/C(=O)N[C@@H]1CC[C@@]2([C@@]34[C@H]1Oc1c4c(C[C@H]2N(CC3)CC2CC2)ccc1O)O
Molecular Formula:
C25H30N2O6
Molecular Weight:
454.515
Log P:
1.4991
Hydrogen Bond Acceptor:
8
Hydrogen Bond Donor:
3
TPSA:
108.33
CAS Number(s):
72782-05-9
Synonym(s)
1.
beta-funaltrexamine
2.
beta-FNA
3.
beta-funaltrexamine monohydrochloride, (E)-isomer
4.
naltrexone fumarate methyl ester
External Link(s)
MeSHC024524
PubChem Compound5311018
BindingDB50247803
ChEBI81527
CHEMBLCHEMBL473136
IUPHAR/BPS Guide to PHARMACOLOGY1631
KEGGcpd:C18127
Therapeutic Target DatabaseD0WT7H
ZINC3995756
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Morphine Dependence3720824CTD
2Substance Withdrawal Syndrome3720824CTD
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