Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00001058661 | Gold | Pesticide4_Ivermectin_C48H74O14_22,23-dihydroavermectin&B1 |
| CCMSLIB00001058666 | Gold | Pesticide4_Ivermectin_C48H74O14_22,23-dihydroavermectin&B1 |
| CCMSLIB00001058893 | Gold | Pesticide4_Ivermectin_C48H74O14_22,23-dihydroavermectin&B1 |
| CCMSLIB00001059021 | Gold | Pesticide4_Ivermectin_C48H74O14_22,23-dihydroavermectin&B1 |
| CCMSLIB00001058390 | Gold | Pesticide4_Ivermectin_C48H74O14_22,23-dihydroavermectin&B1 |
| CCMSLIB00000078110 | Gold | Ivermectin |
| CCMSLIB00010113328 | Gold | 3 |
| CCMSLIB00010113329 | Gold | 3 |
| CCMSLIB00010113330 | Gold | 3 |
| CCMSLIB00010124654 | Gold | 3 |
| CCMSLIB00010124655 | Gold | 3 |
| CCMSLIB00010124656 | Gold | 3 |
| CCMSLIB00012139386 | Gold | 4 |
| CCMSLIB00012139388 | Gold | 4 |
| CCMSLIB00012139384 | Gold | 4 |
| CCMSLIB00012139387 | Gold | 4 |
| CCMSLIB00012139385 | Gold | 4 |
| CCMSLIB00009979183 | Gold | 4 |
| CCMSLIB00009979185 | Gold | 4 |
| CCMSLIB00009979181 | Gold | 4 |
| CCMSLIB00009979184 | Gold | 4 |
| CCMSLIB00009979182 | Gold | 4 |
COMPOUND NPA013559
PROPERTIES
| NPAID | NPA013559 |
|---|---|
| CLUSTER ID | 243 |
| NODE ID | 223 |
| NAME | Ivermectin |
| FORMULA | C48H74O14 |
| MOLECULAR WEIGHT (Da) | 875.1060 |
| ACCURATE MASS (Da) | 874.5079 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | avermitilis |
| InChIKey | AZSNMRSAGSSBNP-LFOOHIAMSA-N |
| InChI | InChI=1S/C48H74O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,19,25-26,28,30-31,33-45,49-50,52H,11,16-18,20-24H2,1-10H3/b13-12+,27-15+,32-14+/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43-,44-,45+,47+,48+/m0/s1 |
| SMILES | CC[C@H](C)[C@H]1[C@H](CC[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Campbell, WC; Fisher, MH; Stapley, EO; Albers-Schonberg, G; Jacob, TA Ivermectin: a potent new antiparasitic agent Science 1983 221 (4613) 823-828. | ||
|---|---|---|---|
| DOI | 10.1126/science.6308762 | PMID | 6308762 |
