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CHEBI:143707 - 7-epi-cylindrospermopsin zwitterion
| Formula | C15H21N5O7S |
| Net Charge | 0 |
| Average Mass | 415.428 |
| Monoisotopic Mass | 415.11617 |
| SMILES | [H][C@]12C[C@H](OS(=O)(=O)[O-])[C@H](C)[C@@]3([H])CNC(=[N+]13)N[C@@]([H])([C@H](O)c1cc(=O)nc(=O)n1)C2 |
| InChI | InChI=1S/C15H21N5O7S/c1-6-10-5-16-14-17-8(13(22)9-4-12(21)19-15(23)18-9)2-7(20(10)14)3-11(6)27-28(24,25)26/h4,6-8,10-11,13,22H,2-3,5H2,1H3,(H4,16,17,18,19,21,23,24,25,26)/t6-,7+,8-,10-,11+,13+/m1/s1 |
| InChIKey | KDNLTVRXCBZFNF-YUQKHPEDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-epi-cylindrospermopsin zwitterion (CHEBI:143707) is a zwitterion (CHEBI:27369) |
| 7-epi-cylindrospermopsin zwitterion (CHEBI:143707) is tautomer of 7-epi-cylindrospermopsin (CHEBI:88049) |
| Incoming Relation(s) |
| 7-epi-cylindrospermopsin (CHEBI:88049) is tautomer of 7-epi-cylindrospermopsin zwitterion (CHEBI:143707) |
| UniProt Name | Source |
|---|---|
| 7-epi-cylindrospermopsin | UniProt |
| Manual Xrefs | Databases |
|---|---|
| CPD-22145 | MetaCyc |
| Citations |
|---|