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CHEBI:9240 - spirolucidine
| Formula | C30H49N3O2 |
| Net Charge | 0 |
| Average Mass | 483.741 |
| Monoisotopic Mass | 483.38248 |
| SMILES | [H][C@]1(C[C@H]2CCC(=O)[C@@]3(C[C@]4([H])C[C@@H](C)C[C@@H]5N(C)C[C@H]3C[C@@]54[H])N2)C[C@H](C)C[C@]2([H])N(C(C)=O)CCC[C@]12[H] |
| InChI | InChI=1S/C30H49N3O2/c1-18-10-21(25-6-5-9-33(20(3)34)28(25)13-18)14-24-7-8-29(35)30(31-24)16-22-11-19(2)12-27-26(22)15-23(30)17-32(27)4/h18-19,21-28,31H,5-17H2,1-4H3/t18-,19+,21+,22-,23+,24+,25+,26+,27-,28-,30-/m0/s1 |
| InChIKey | DOAGKNAZGHOTJU-PALKDTOHSA-N |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| spirolucidine (CHEBI:9240) is a azaspiro compound (CHEBI:35624) |
| spirolucidine (CHEBI:9240) is a decahydroquinoline alkaloid (CHEBI:47009) |
| spirolucidine (CHEBI:9240) is a piperidines (CHEBI:26151) |
| IUPAC Name |
|---|
| (1R,2S,4S,6R,6'R,8S,9R)-6'-{[(4aR,5R,7S,8aS)-1-acetyl-7-methyldecahydroquinolin-5-yl]methyl}-6,12-dimethyl-3'H-spiro[12-azatricyclo[6.2.2.04,9]dodecane-2,2'-piperidin]-3'-one |
| Synonym | Source |
|---|---|
| Spirolucidine | KEGG COMPOUND |