EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H24O6 |
| Net Charge | 0 |
| Average Mass | 372.417 |
| Monoisotopic Mass | 372.15729 |
| SMILES | CC(C)CC[C@@]1(O)c2cc3c(O)cccc3cc2C(=O)[C@@H](C)[C@]1(O)C(=O)O |
| InChI | InChI=1S/C21H24O6/c1-11(2)7-8-20(26)16-10-14-13(5-4-6-17(14)22)9-15(16)18(23)12(3)21(20,27)19(24)25/h4-6,9-12,22,26-27H,7-8H2,1-3H3,(H,24,25)/t12-,20-,21+/m1/s1 |
| InChIKey | QUASHMJEJFFXLB-YFMVFKIRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (6209258) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Rishirilide B (CHEBI:224970) is a anthracenes (CHEBI:46955) |
| IUPAC Name |
|---|
| (1R,2R,3S)-1,2,8-trihydroxy-3-methyl-1-(3-methylbutyl)-4-oxo-3H-anthracene-2-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 78443272 | ChemSpider |