EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H35NO5 |
| Net Charge | 0 |
| Average Mass | 429.557 |
| Monoisotopic Mass | 429.25152 |
| SMILES | C[C@H]1CC[C@H]2C(C)(C)[C@H](O)CC[C@]2(C)[C@@]12Cc1c(O)cc3c(c1O2)CN(CCO)C3=O |
| InChI | InChI=1S/C25H35NO5/c1-14-5-6-19-23(2,3)20(29)7-8-24(19,4)25(14)12-16-18(28)11-15-17(21(16)31-25)13-26(9-10-27)22(15)30/h11,14,19-20,27-29H,5-10,12-13H2,1-4H3/t14-,19-,20+,24-,25+/m0/s1 |
| InChIKey | ZHECNBLIOXZXBL-FVFQVNOOSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Stachybotrys (ncbitaxon:74721) | - | PubMed (24387683) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Chartarlactam N (CHEBI:215056) is a isoindoles (CHEBI:24897) |
| IUPAC Name |
|---|
| (3R,4aS,7S,8R,8aS)-3,4'-dihydroxy-7'-(2-hydroxyethyl)-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrouro[2,3-e]isoindole]-6'-one |
| Manual Xrefs | Databases |
|---|---|
| 31128915 | ChemSpider |