Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA029725
PROPERTIES
| NPAID | NPA029725 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Ilamycin G |
| FORMULA | C54H75N9O13 |
| MOLECULAR WEIGHT (Da) | 1058.2440 |
| ACCURATE MASS (Da) | 1057.5484 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | atratus SCSIO ZH16 ΔilaR |
| InChIKey | QWHKOZHKPNTTDE-VCWQNSNGSA-N |
| InChI | InChI=1S/C54H75N9O13/c1-12-14-18-37-46(66)59-40(27-35-28-62(54(9,13-2)29-64)41-19-16-15-17-36(35)41)52(72)61(11)43(23-31(5)6)49(69)58-39(25-34-20-21-45(65)42(26-34)63(75)76)47(67)55-33(8)51(71)60(10)44(24-32(7)53(73)74)50(70)57-38(22-30(3)4)48(68)56-37/h12-17,19-21,26,28,30-33,37-40,43-44,64-65H,2,18,22-25,27,29H2,1,3-11H3,(H,55,67)(H,56,68)(H,57,70)(H,58,69)(H,59,66)(H,73,74)/t32-,33-,37-,38-,39-,40-,43-,44-,54+/m0/s1 |
| SMILES | C=C[C@](C)(CO)N1C=C(C[C@@H]2NC(=O)[C@H](CC=CC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C[C@H](C)C(=O)O)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC3=CC([N+](=O)[O-])=C(O)C=C3)NC(=O)[C@H](CC(C)C)N(C)C2=O)C2=CC=CC=C21 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Fan, Zhiying; Huang, Xuanmei; Ju, Jianhua; Liu, Zhiyong; Ma, Junying; Qin, Xiangjing; Sun, Changli; Wu, Qiaoling; Zhang, Hua; Zhang, Tianyu; Zheng, Xiaohong; Zhu, Xiangcheng Antitubercular Ilamycins from Marine-Derived Streptomyces atratus SCSIO ZH16 Δ ilaR Journal of Natural Products 2020 83 (5) 1646-1657. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.0c00151 | PMID | 32324401 |
