EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H13N3O7S |
| Net Charge | -2 |
| Average Mass | 415.383 |
| Monoisotopic Mass | 415.04852 |
| SMILES | CC(=O)N[C@@H](CSc1c2nc3cc(C(=O)[O-])ccc3oc-2cc(=O)c1N)C(=O)[O-] |
| InChI | InChI=1S/C18H15N3O7S/c1-7(22)20-10(18(26)27)6-29-16-14(19)11(23)5-13-15(16)21-9-4-8(17(24)25)2-3-12(9)28-13/h2-5,10H,6,19H2,1H3,(H,20,22)(H,24,25)(H,26,27)/p-2/t10-/m0/s1 |
| InChIKey | KUPQDUIOULXTJZ-JTQLQIEISA-L |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| grixazone B(2−) (CHEBI:73483) is a L-α-amino acid anion (CHEBI:59814) |
| grixazone B(2−) (CHEBI:73483) is conjugate base of grixazone B (CHEBI:73548) |
| Incoming Relation(s) |
| grixazone B (CHEBI:73548) is conjugate acid of grixazone B(2−) (CHEBI:73483) |
| IUPAC Name |
|---|
| 1-{[(2R)-2-acetamido-2-carboxylatoethyl]sulfanyl}-2-amino-3-oxo-3H-phenoxazine-8-carboxylate |
| Synonym | Source |
|---|---|
| grixazone B dianion | ChEBI |
| UniProt Name | Source |
|---|---|
| grixazone B | UniProt |
| Manual Xrefs | Databases |
|---|---|
| CPD-14875 | MetaCyc |
| Citations |
|---|