EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H26O5 |
| Net Charge | -2 |
| Average Mass | 346.423 |
| Monoisotopic Mass | 346.17912 |
| SMILES | [H][C@@]12CC[C@]3(O)C[C@]1(CC3=C)[C@@H](C(=O)[O-])[C@@]1([H])[C@@]2(C)CCC[C@@]1(C)C(=O)[O-] |
| InChI | InChI=1S/C20H28O5/c1-11-9-19-10-20(11,25)8-5-12(19)17(2)6-4-7-18(3,16(23)24)14(17)13(19)15(21)22/h12-14,25H,1,4-10H2,2-3H3,(H,21,22)(H,23,24)/p-2/t12-,13+,14-,17-,18+,19-,20-/m0/s1 |
| InChIKey | CZEMYYICWZPENF-VOLTXKGXSA-L |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| gibberellin A53(2−) (CHEBI:143954) is a dicarboxylic acid dianion (CHEBI:28965) |
| gibberellin A53(2−) (CHEBI:143954) is a gibberellin carboxylic acid anion (CHEBI:59139) |
| gibberellin A53(2−) (CHEBI:143954) is conjugate base of gibberellin A53 (CHEBI:27433) |
| Incoming Relation(s) |
| gibberellin A53 (CHEBI:27433) is conjugate acid of gibberellin A53(2−) (CHEBI:143954) |
| UniProt Name | Source |
|---|---|
| gibberellin A53 | UniProt |
| Manual Xrefs | Databases |
|---|---|
| CPD-695 | MetaCyc |