Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA024389
PROPERTIES
| NPAID | NPA024389 |
|---|---|
| CLUSTER ID | 1582 |
| NODE ID | 1298 |
| NAME | Crochelin D |
| FORMULA | C36H65N9O14 |
| MOLECULAR WEIGHT (Da) | 847.9650 |
| ACCURATE MASS (Da) | 847.4651 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Unknown-bacterium |
| ORIGIN SPECIES | sp. |
| InChIKey | BMJKETJRCKATKC-YSUDGMSFSA-N |
| InChI | InChI=1S/C36H65N9O14/c1-2-3-4-5-6-7-8-13-28(50)40-25(20-46)27(49)19-29(51)41-26(21-47)34(55)44-30(31(52)36(57)58)35(56)43-24(14-16-38)33(54)42-23(12-11-18-45(59)22-48)32(53)39-17-10-9-15-37/h5-6,22-27,30-31,46-47,49,52,59H,2-4,7-21,37-38H2,1H3,(H,39,53)(H,40,50)(H,41,51)(H,42,54)(H,43,56)(H,44,55)(H,57,58)/t23-,24-,25?,26-,27?,30-,31+/m0/s1 |
| SMILES | CCCCC=CCCCC(=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 |
