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CHEBI:221168 - Huptremule B
| Formula | C30H38N2O5 |
| Net Charge | 0 |
| Average Mass | 506.643 |
| Monoisotopic Mass | 506.27807 |
| SMILES | C/C=C1\[C@H]2C=C(C)C[C@]1(NC1OC(=O)C3=C4CC(C)(C)CC4C(C)C(O)CC31O)c1ccc(=O)nc1C2 |
| InChI | InChI=1S/C30H38N2O5/c1-6-20-17-9-15(2)11-29(20,21-7-8-24(34)31-22(21)10-17)32-27-30(36)14-23(33)16(3)18-12-28(4,5)13-19(18)25(30)26(35)37-27/h6-9,16-18,23,27,32-33,36H,10-14H2,1-5H3,(H,31,34)/b20-6+/t16?,17-,18?,23?,27?,29+,30?/m0/s1 |
| InChIKey | LBHVCNVTMBHJEE-WNHXZTDBSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ceriporia (ncbitaxon:40427) | - | PubMed (25222040) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Huptremule B (CHEBI:221168) is a hydroxypyridine (CHEBI:24745) |
| IUPAC Name |
|---|
| (1R,9R,13E)-1-[(3a,5-dihydroxy-6,8,8-trimethyl-1-oxo-4,5,6,6a,7,9-hexahydro-3H-azuleno[4,5-c]uran-3-yl)amino]-13-ethylidene-11-methyl-6-azatricyclo[7.3.1.02,7]trideca-2(7),3,10-trien-5-one |
| Manual Xrefs | Databases |
|---|---|
| 78445612 | ChemSpider |