Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA024387
PROPERTIES
| NPAID | NPA024387 |
|---|---|
| CLUSTER ID | 1582 |
| NODE ID | 1298 |
| NAME | Crochelin B |
| FORMULA | C38H71N9O14 |
| MOLECULAR WEIGHT (Da) | 878.0350 |
| ACCURATE MASS (Da) | 877.5120 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Unknown-bacterium |
| ORIGIN SPECIES | sp. |
| InChIKey | INSJWRJBLNYTMW-NLTPFZDQSA-N |
| InChI | InChI=1S/C38H71N9O14/c1-2-3-4-5-6-7-8-9-10-15-30(52)42-27(22-48)29(51)21-31(53)43-28(23-49)36(57)46-32(33(54)38(59)60)37(58)45-26(16-18-40)35(56)44-25(14-13-20-47(61)24-50)34(55)41-19-12-11-17-39/h24-29,32-33,48-49,51,54,61H,2-23,39-40H2,1H3,(H,41,55)(H,42,52)(H,43,53)(H,44,56)(H,45,58)(H,46,57)(H,59,60)/t25-,26-,27?,28-,29?,32-,33+/m0/s1 |
| SMILES | CCCCCCCCCCCC(=O)NC(CO)C(CC(=O)N[C@@H](CO)C(=O)N[C@@H]([C@H](C(=O)O)O)C(=O)N[C@@H](CCN)C(=O)N[C@@H](CCCN(C=O)O)C(=O)NCCCCN)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Baars, Oliver; Zhang, Xinning; Gibson, Marcus I.; Stone, Alan T.; Morel, François M. M.; Seyedsayamdost, Mohammad R. Crochelins: Siderophores with an Unprecedented Iron-Chelating Moiety from the Nitrogen-Fixing Bacterium Azotobacter chroococcum Angewandte Chemie International Edition 2018 57 (2) 536-541. | ||
|---|---|---|---|
| DOI | 10.1002/anie.201709720 | PMID | 29134779 |
