Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00004685155 | Bronze | (2E,6E,11E)-18-(2,6-dioxopiperidin-4-yl)-9,13-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11-trienoic&acid |
| CCMSLIB00004685156 | Bronze | (2E,6E,11E)-18-(2,6-dioxopiperidin-4-yl)-9,13-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11-trienoic&acid |
| CCMSLIB00004685157 | Bronze | (2E,6E,11E)-18-(2,6-dioxopiperidin-4-yl)-9,13-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11-trienoic&acid |
| CCMSLIB00004685158 | Bronze | (2E,6E,11E)-18-(2,6-dioxopiperidin-4-yl)-9,13-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxooctadeca-2,6,11-trienoic&acid |
COMPOUND NPA015916
PROPERTIES
| NPAID | NPA015916 |
|---|---|
| CLUSTER ID | 945 |
| NODE ID | 813 |
| NAME | 13-epi-dorrigocin A |
| FORMULA | C27H41NO8 |
| MOLECULAR WEIGHT (Da) | 507.6240 |
| ACCURATE MASS (Da) | 507.2832 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | platensis NRRL18993 |
| InChIKey | HJCZOTBHYAPUHT-FFMZNCFZSA-N |
| InChI | InChI=1S/C27H41NO8/c1-17(14-18(2)27(35)22(36-4)12-7-5-6-8-13-25(32)33)26(34)19(3)21(29)11-9-10-20-15-23(30)28-24(31)16-20/h7-8,12-14,18-20,22,26-27,34-35H,5-6,9-11,15-16H2,1-4H3,(H,32,33)(H,28,30,31)/b12-7+,13-8+,17-14+/t18-,19-,22+,26-,27+/m1/s1 |
| SMILES | C[C@H](/C=C(\C)/[C@H]([C@H](C)C(=O)CCCC1CC(=O)NC(=O)C1)O)[C@@H]([C@H](/C=C/CC/C=C/C(=O)O)OC)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ju, Jianhua; Lim, Si-Kyu; Jiang, Hui; Shen, Ben Migrastatin and dorrigocins are shunt metabolites of iso-migrastatin Journal of the American Chemical Society 2005 127 (6) 1622-1623. | ||
|---|---|---|---|
| DOI | 10.1021/ja043808i | PMID | 15700980 |
