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CHEBI:197745 - Bacilosarcin C
| Formula | C24H34N2O9 |
| Net Charge | 0 |
| Average Mass | 494.541 |
| Monoisotopic Mass | 494.22643 |
| SMILES | CC(C)C[C@H](NC(=O)[C@@H](O)[C@H]1O[C@](C)(O)[C@H](C)N[C@H]1CC(=O)O)[C@@H]1Cc2cccc(O)c2C(=O)O1 |
| InChI | InChI=1S/C24H34N2O9/c1-11(2)8-14(17-9-13-6-5-7-16(27)19(13)23(32)34-17)26-22(31)20(30)21-15(10-18(28)29)25-12(3)24(4,33)35-21/h5-7,11-12,14-15,17,20-21,25,27,30,33H,8-10H2,1-4H3,(H,26,31)(H,28,29)/t12-,14-,15-,17-,20-,21-,24-/m0/s1 |
| InChIKey | AGFNOCSXEIUTSA-SHJDBJNPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Bacillus (ncbitaxon:1386) | - | PubMed (22412803) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Bacilosarcin C (CHEBI:197745) is a 2-benzopyran (CHEBI:38444) |
| IUPAC Name |
|---|
| 2-[(2S,3S,5S,6S)-6-hydroxy-2-[(1S)-1-hydroxy-2-[[(1S)-1-[(3S)-8-hydroxy-1-oxo-3,4-dihydroisochromen-3-yl]-3-methylbutyl]amino]-2-oxoethyl]-5,6-dimethylmorpholin-3-yl]acetic acid |
| Manual Xrefs | Databases |
|---|---|
| 29214740 | ChemSpider |