deoxyuvidin B
(4S,4aR,7S,8aR)-7-hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-4H-naphthalen-1-one
Also Known As: deoxyuvidin B|deoxyuvidin|Benzenemethanamine,N-methylene-,N-oxide|J2.773.840K|1(4H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-7-hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-, (4S-(4alpha,4aalpha,7alpha,8abeta))-|(4S,4aR,7S,8aR)-7-hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-one|(4S,4aR,7S,8aR)-7-Hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-4a,5,6,7,8,8a-hexahydronaphthalen-1(4H)-one|(4S,4aR,7S,8aR)-7-hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-4H-naphthalen-1-one|3,4aalpha,8,8-Tetramethyl-4alpha-(hydroxymethyl)-7alpha-hydroxy-1,4,4a,5,6,7,8,8abeta-octahydronaphthalene-1-one|7-Hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-4a,5,6,7,8,8a-hexahydronaphthalen-1(4H)-one
| Molecular Formula | C15H24O3 |
|---|---|
| Molecular Weight | 252.17255 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 252.17255 |
| Monoisotopic Mass | 252.17255 |
| Heavy Atoms | 18 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 74635-90-8 |
|---|---|
| SMILES | CC1=CC(=O)[C@@H]2[C@@]([C@H]1CO)(CC[C@@H](C2(C)C)O)C |
| InChIKey | VVTJHIHLGAFNHR-GZCFXPHUSA-N |
Product Overview
deoxyuvidin B (CAS 74635-90-8), with molecular formula C15H24O3 and molecular weight 252.17255 g/mol. IUPAC: (4S,4aR,7S,8aR)-7-hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-4H-naphthalen-1-one.
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