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CHEBI:129483 - [(8S,9R,10S)-6-(3-methoxyphenyl)sulfonyl-9-[4-(4-methylpent-1-ynyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol
| Formula | C28H36N2O4S |
| Net Charge | 0 |
| Average Mass | 496.673 |
| Monoisotopic Mass | 496.23958 |
| SMILES | COc1cccc(S(=O)(=O)N2CCCCN3[C@H](CO)[C@H](c4ccc(C#CCC(C)C)cc4)[C@H]3C2)c1 |
| InChI | InChI=1S/C28H36N2O4S/c1-21(2)8-6-9-22-12-14-23(15-13-22)28-26-19-29(16-4-5-17-30(26)27(28)20-31)35(32,33)25-11-7-10-24(18-25)34-3/h7,10-15,18,21,26-28,31H,4-5,8,16-17,19-20H2,1-3H3/t26-,27-,28-/m1/s1 |
| InChIKey | WJFNNSWULALGOK-JCYYIGJDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [(8S,9R,10S)-6-(3-methoxyphenyl)sulfonyl-9-[4-(4-methylpent-1-ynyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:129483) is a azetidines (CHEBI:38777) |
| [(8S,9R,10S)-6-(3-methoxyphenyl)sulfonyl-9-[4-(4-methylpent-1-ynyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:129483) is a benzenes (CHEBI:22712) |
| [(8S,9R,10S)-6-(3-methoxyphenyl)sulfonyl-9-[4-(4-methylpent-1-ynyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:129483) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-41034 | LINCS |