Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA009364
PROPERTIES
| NPAID | NPA009364 |
|---|---|
| CLUSTER ID | 34 |
| NODE ID | 33 |
| NAME | Cyclic trichrysobactin |
| FORMULA | C48H63N9O18 |
| MOLECULAR WEIGHT (Da) | 1054.0770 |
| ACCURATE MASS (Da) | 1053.4291 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Dickeya |
| ORIGIN SPECIES | chrysanthemi ec16 |
| InChIKey | UCQNSMWQRQITLO-OKYIMTKNSA-N |
| InChI | InChI=1S/C48H63N9O18/c49-19-4-1-13-28(52-40(64)25-10-7-16-34(58)37(25)61)43(67)55-31-22-73-47(71)33(57-45(69)30(15-3-6-21-51)54-42(66)27-12-9-18-36(60)39(27)63)24-75-48(72)32(23-74-46(31)70)56-44(68)29(14-2-5-20-50)53-41(65)26-11-8-17-35(59)38(26)62/h7-12,16-18,28-33,58-63H,1-6,13-15,19-24,49-51H2,(H,52,64)(H,53,65)(H,54,66)(H,55,67)(H,56,68)(H,57,69)/t28-,29-,30-,31+,32+,33+/m1/s1 |
| SMILES | C1[C@@H](C(=O)OC[C@@H](C(=O)OC[C@@H](C(=O)O1)NC(=O)[C@@H](CCCCN)NC(=O)C2=C(C(=CC=C2)O)O)NC(=O)[C@@H](CCCCN)NC(=O)C3=C(C(=CC=C3)O)O)NC(=O)[C@@H](CCCCN)NC(=O)C4=C(C(=CC=C4)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Sandy, Moriah; Butler, Alison Chrysobactin siderophores produced by Dickeya chrysanthemi ec16 Journal of Natural Products 2011 74 (5) 1207-1212. | ||
|---|---|---|---|
| DOI | 10.1021/np200126z | PMID | 21545171 |
