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3-Acetyl-6-Deoxy-6-Fluoronaltrexone
[CAS# 94696-53-4]

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CAS#: 94696-53-4
Product: 3-Acetyl-6-Deoxy-6-Fluoronaltrexone
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Identification
Name 3-Acetyl-6-Deoxy-6-Fluoronaltrexone
Synonyms 3-Acetyl-6-Deoxy-6-Fluoronaltrexone; 3-Acetylcyclofoxy
Molecular Structure CAS#: 94696-53-4, 3-Acetyl-6-Deoxy-6-Fluoronaltrexone
Molecular Formula C22H26FNO4
Molecular Weight 387.45
CAS Registry Number 94696-53-4
SMILES [C@@H]25CC1=CC=C(C4=C1[C@@]3([C@]2(CC[C@H]([C@@H]3O4)F)O)CCN5CC6CC6)OC(C)=O
InChI 1S/C22H26FNO4/c1-12(25)27-16-5-4-14-10-17-22(26)7-6-15(23)20-21(22,18(14)19(16)28-20)8-9-24(17)11-13-2-3-13/h4-5,13,15,17,20,26H,2-3,6-11H2,1H3/t15-,17-,20+,21+,22-/m1/s1
InChIKey ZCCDUPABBHUDLO-VSHLJNTCSA-N
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