Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017291
PROPERTIES
| NPAID | NPA017291 |
|---|---|
| CLUSTER ID | 2605 |
| NODE ID | 2027 |
| NAME | Ganefromycin ε |
| FORMULA | C36H53NO9 |
| MOLECULAR WEIGHT (Da) | 643.8180 |
| ACCURATE MASS (Da) | 643.3720 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Unknown-fungus |
| ORIGIN SPECIES | sp. |
| InChIKey | RNCHOJALTYLGCU-JWUJFNNNSA-N |
| InChI | InChI=1S/C36H53NO9/c1-8-9-12-19-31-35(5,6)30(39)23-36(43,46-31)26(4)34(42)37-21-16-15-17-24(2)33(44-7)25(3)29-22-27(38)28(45-29)18-13-10-11-14-20-32(40)41/h8-20,25-31,33,38-39,43H,21-23H2,1-7H3,(H,37,42)(H,40,41)/b9-8-,11-10+,16-15+,18-13+,19-12+,20-14-,24-17+/t25?,26-,27?,28?,29?,30?,31?,33?,36?/m1/s1 |
| SMILES | C/C=C\C=C\C1C(C(CC(O1)([C@H](C)C(=O)NC/C=C/C=C(\C)/C(C(C)C2CC(C(O2)/C=C/C=C/C=C\C(=O)O)O)OC)O)O)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | CARTER, GUY T.; TISCHLER, MARK; WEST, ROBERT R.; BAILEY, ARTHUR E. Base-catalyzed Isomerism in Elfamycin Antibiotics. Structures of Ganefromycins .EPSILON. and .EPSILON.1 Journal of Antibiotics 1995 48 (11) 1312-1319. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.48.1312 | PMID | 25754859 |
