Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00003136537 | Gold | 3 |
| CCMSLIB00003138151 | Gold | 3 |
| CCMSLIB00012141839 | Gold | 4 |
| CCMSLIB00009981636 | Gold | 4 |
| CCMSLIB00010111110 | Gold | 3 |
| CCMSLIB00010111111 | Gold | 3 |
| CCMSLIB00010111112 | Gold | 3 |
| CCMSLIB00010122445 | Gold | 3 |
| CCMSLIB00010122446 | Gold | 3 |
| CCMSLIB00010122447 | Gold | 3 |
COMPOUND NPA003907
PROPERTIES
| NPAID | NPA003907 |
|---|---|
| CLUSTER ID | 589 |
| NODE ID | 525 |
| NAME | C-17-epi-Deoxy-0,8-salinomycin |
| FORMULA | C42H70O11 |
| MOLECULAR WEIGHT (Da) | 751.0110 |
| ACCURATE MASS (Da) | 750.4918 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | albus |
| InChIKey | KQXDHUJYNAXLNZ-IBKCOUPJSA-N |
| InChI | InChI=1S/C42H70O11/c1-11-29(38(46)47)31-15-14-23(4)36(50-31)27(8)34(44)26(7)35(45)30(12-2)37-24(5)22-25(6)41(51-37)19-16-32(43)42(53-41)21-20-39(10,52-42)33-17-18-40(48,13-3)28(9)49-33/h16,19,23-34,36-37,43-44,48H,11-15,17-18,20-22H2,1-10H3,(H,46,47)/t23-,24-,25+,26-,27-,28-,29+,30-,31+,32+,33+,34+,36+,37-,39-,40+,41?,42-/m0/s1 |
| SMILES | CC[C@H]([C@H]1CC[C@@H]([C@@H](O1)[C@@H](C)[C@@H]([C@H](C)C(=O)[C@H](CC)[C@@H]2[C@H](C[C@H](C3(O2)C=C[C@H]([C@@]4(O3)CC[C@@](O4)(C)[C@H]5CC[C@@]([C@@H](O5)C)(CC)O)O)C)C)O)C)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Westley, J W; Blount, J F; Evans, R H; Liu, C M C-17 epimers of deoxy-(O-8)-salinomycin from Streptomyces albus (ATCC 21838) Journal of Antibiotics 1977 30 (7) 610-612. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.30.610 | PMID | 893229 |
