Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005720202 | Gold | 3 |
COMPOUND NPA022444
PROPERTIES
| NPAID | NPA022444 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Thermoactinoamide A |
| FORMULA | C38H62N6O7 |
| MOLECULAR WEIGHT (Da) | 714.9490 |
| ACCURATE MASS (Da) | 714.4680 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Thermoactinomyces |
| ORIGIN SPECIES | vulgaris |
| InChIKey | UIQRJAVAEKADLA-IEWQEYRSSA-N |
| InChI | InChI=1S/C38H62N6O7/c1-11-24(10)32-38(51)42-30(19-25-12-14-26(45)15-13-25)36(49)43-31(23(8)9)37(50)41-28(17-21(4)5)34(47)39-27(16-20(2)3)33(46)40-29(18-22(6)7)35(48)44-32/h12-15,20-24,27-32,45H,11,16-19H2,1-10H3,(H,39,47)(H,40,46)(H,41,50)(H,42,51)(H,43,49)(H,44,48)/t24-,27+,28-,29-,30+,31-,32+/m0/s1 |
| SMILES | CC[C@H](C)[C@@H]1C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)CC(C)C)CC(C)C)CC(C)C)C(C)C)CC2=CC=C(C=C2)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Teta, Roberta; Marteinsson, Viggó Thór; Longeon, Arlette; Klonowski, Alexandra M.; Groben, René; Bourguet-Kondracki, Marie-Lise; Costantino, Valeria; Mangoni, Alfonso Thermoactinoamide A, an Antibiotic Lipophilic Cyclopeptide from the Icelandic Thermophilic Bacterium Thermoactinomyces vulgaris Journal of Natural Products 2017 80 (9) 2530-2535. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.7b00560 | PMID | 28841315 |
