EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C31H35O9 |
| Net Charge | -1 |
| Average Mass | 551.612 |
| Monoisotopic Mass | 551.22866 |
| SMILES | [H][C@@]12C3=C(C[C@@]4(CC(=O)[O-])C(=O)OC15O[C@]([H])(C(=O)CC/C=C/C)C[C@@H]2[C@@H](CCCCC/C=C/C)C=C54)C(=O)OC3=O |
| InChI | InChI=1S/C31H36O9/c1-3-5-7-8-9-11-12-18-14-23-30(17-24(33)34)16-20-25(28(36)38-27(20)35)26-19(18)15-22(21(32)13-10-6-4-2)39-31(23,26)40-29(30)37/h3-6,14,18-19,22,26H,7-13,15-17H2,1-2H3,(H,33,34)/p-1/b5-3+,6-4+/t18-,19+,22-,26+,30-,31?/m0/s1 |
| InChIKey | PZLSMKXFWOLXHD-IXOQEDOXSA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (−)-phomoidride B(1−) (CHEBI:197432) is a monocarboxylic acid anion (CHEBI:35757) |
| (−)-phomoidride B(1−) (CHEBI:197432) is conjugate base of (−)-phomoidride B (CHEBI:197409) |
| Incoming Relation(s) |
| (−)-phomoidride B (CHEBI:197409) is conjugate acid of (−)-phomoidride B(1−) (CHEBI:197432) |
| UniProt Name | Source |
|---|---|
| (−)-phomoidride B | UniProt |