Stemodinone
(2S,7S,10S,12S,13S)-13-hydroxy-2,6,6,13-tetramethyltetracyclo[10.3.1.01,10.02,7]hexadecan-4-one
Also Known As: Stemodinone|KST-1A5633|(4as,6as,8s,9s,11bs)-9-hydroxy-4,4,9,11b-tetramethyldodecahydro-8,11a-methanocyclohepta[a]naphthalen-2(1h)-one|9-Hydroxy-4,4,9,11b-tetramethyldodecahydro-8,11a-methanocyclohepta[a]naphthalen-2(1H)-one|(2S,7S,10S,12S,13S)-13-Hydroxy-2,6,6,13-tetramethyltetracyclo[10.3.1.01,10.02,7]hexadecan-4-one|8,11a-Methano-11aH-cyclohepta[a]naphthalen- 2(1H)-one,dodecahydro-9-hydroxy-4,4,9,11btetramethyl-,(4aS,6aS,8S,9S,11aR,11bS)-|8,11a-Methano-11aH-cyclohepta[a]naphthalen-2(1H)-one, dodecahydro-9-hydroxy-4,4,9,11b-tetramethyl-, [4aS-(4a.alpha.,6a.beta.,8.alpha.,9.alpha.,11a.alpha.,11b.beta.)]-
| Molecular Formula | C20H32O2 |
|---|---|
| Molecular Weight | 304.24023 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 304.24023 |
| Monoisotopic Mass | 304.24023 |
| Heavy Atoms | 22 |
| Complexity | 524.0 |
Chemical Identifiers
| CAS Number | 5411-63-2 |
|---|---|
| SMILES | C[C@@]1(CCC23C[C@@H]1C[C@@H]2CC[C@@H]4[C@@]3(CC(=O)CC4(C)C)C)O |
| InChIKey | MTHCEQRYJNYWKN-KRHFWKMTSA-N |
Product Overview
Stemodinone (CAS 5411-63-2), with molecular formula C20H32O2 and molecular weight 304.24023 g/mol. IUPAC: (2S,7S,10S,12S,13S)-13-hydroxy-2,6,6,13-tetramethyltetracyclo[10.3.1.01,10.02,7]hexadecan-4-one.
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