Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA012441
PROPERTIES
| NPAID | NPA012441 |
|---|---|
| CLUSTER ID | 1025 |
| NODE ID | 883 |
| NAME | Quinomycin G |
| FORMULA | C51H64N12O12S2 |
| MOLECULAR WEIGHT (Da) | 1101.2790 |
| ACCURATE MASS (Da) | 1100.4208 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. LS298 |
| InChIKey | ADNJLVHPFULEDD-DBFOERGLSA-N |
| InChI | InChI=1S/C51H64N12O12S2/c1-25(2)38(49(72)73)61(9)48(71)40-51(76-12)77-24-37(60(8)45(68)28(6)55-41(64)27(5)54-42(65)34-21-52-30-17-13-15-19-32(30)57-34)47(70)62(10)39(26(3)4)50(74)75-23-36(44(67)56-29(7)46(69)63(40)11)59-43(66)35-22-53-31-18-14-16-20-33(31)58-35/h13-22,25-26,28-29,36-40,51H,5,23-24H2,1-4,6-12H3,(H,54,65)(H,55,64)(H,56,67)(H,59,66)(H,72,73)/t28-,29-,36+,37-,38-,39-,40+,51?/m0/s1 |
| SMILES | C[C@H]1C(=O)N([C@@H](C(SC[C@@H](C(=O)N([C@H](C(=O)OC[C@H](C(=O)N1)NC(=O)C2=NC3=CC=CC=C3N=C2)C(C)C)C)N(C)C(=O)[C@H](C)NC(=O)C(=C)NC(=O)C4=NC5=CC=CC=C5N=C4)SC)C(=O)N(C)[C@@H](C(C)C)C(=O)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhen, Xin; Gong, Ting; Liu, Fu; Zhang, Pei-Cheng; Zhou, Wan-Qi; Li, Yan; Zhu, Ping A New Analogue of Echinomycin and a New Cyclic Dipeptide from a Marine-Derived Streptomyces sp. LS298 Marine Drugs 2015 13 (11) 6947-6961. | ||
|---|---|---|---|
| DOI | 10.3390/md13116947 | PMID | 26593927 |
