Cas no 84116-46-1 ((5alpha)-7,8-didehydro-4,5-epoxy-3,14-dihydroxymorphinan-6-one)
84116-46-1 structure
Product Name:(5alpha)-7,8-didehydro-4,5-epoxy-3,14-dihydroxymorphinan-6-one
CAS No:84116-46-1
MF:C16H15NO4
MW:285.294604539871
CID:888739
PubChem ID:15605738
Update Time:2025-04-19
(5alpha)-7,8-didehydro-4,5-epoxy-3,14-dihydroxymorphinan-6-one Chemical and Physical Properties
Names and Identifiers
-
- (5alpha)-7,8-didehydro-4,5-epoxy-3,14-dihydroxymorphinan-6-one
- 84116-46-1
- DTXSID10892372
- EINECS 282-186-5
- SCHEMBL13640606
- NS00058484
- 14-hydroxynormorphinone
- 14-Hydroxynor-morphinone
-
- Inchi: 1S/C16H15NO4/c18-9-2-1-8-7-11-16(20)4-3-10(19)14-15(16,5-6-17-11)12(8)13(9)21-14/h1-4,11,14,17-18,20H,5-7H2/t11-,14+,15+,16-/m1/s1
- InChI Key: WJZVCRUPHQAKSZ-IPOQPSJVSA-N
- SMILES: O1C2=C(C=CC3C[C@@H]4[C@@]5(C=CC([C@H]1[C@@]5(C=32)CCN4)=O)O)O
Computed Properties
- Exact Mass: 285.10010796g/mol
- Monoisotopic Mass: 285.10010796g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 0
- Complexity: 548
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.3
- Topological Polar Surface Area: 78.8?2
(5alpha)-7,8-didehydro-4,5-epoxy-3,14-dihydroxymorphinan-6-one Related Literature
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
84116-46-1 ((5alpha)-7,8-didehydro-4,5-epoxy-3,14-dihydroxymorphinan-6-one) Related Products
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