Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA030699
PROPERTIES
| NPAID | NPA030699 |
|---|---|
| CLUSTER ID | 279 |
| NODE ID | 253 |
| NAME | Chetracin F |
| FORMULA | C30H28N6O8S7 |
| MOLECULAR WEIGHT (Da) | 825.0570 |
| ACCURATE MASS (Da) | 824.0014 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Acrostalagmus |
| ORIGIN SPECIES | luteoalbus HDN13-530 |
| InChIKey | CZOVWCYITKRFFT-LRESJZTJSA-N |
| InChI | InChI=1S/C30H28N6O8S7/c1-33-23(43)29-17(39)27(13-7-3-5-9-15(13)31-19(27)35(29)21(41)25(33,11-37)45-49-47-29)28-14-8-4-6-10-16(14)32-20(28)36-22(42)26(12-38)34(2)24(44)30(36,18(28)40)48-51-50-46-26/h3-10,17-20,31-32,37-40H,11-12H2,1-2H3/t17-,18-,19+,20+,25-,26-,27+,28+,29-,30-/m0/s1 |
| SMILES | CN1C(=O)[C@]23SSSS[C@@]1(CO)C(=O)N2[C@H]1NC2=CC=CC=C2[C@@]1([C@@]12C4=CC=CC=C4N[C@@H]1N1C(=O)[C@]4(CO)SSS[C@]1(C(=O)N4C)[C@H]2O)[C@@H]3O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yu G; Wang Y; Yu R; Feng Y; Wang L; Che Q; Gu Q; Li D; Li J; Zhu T Chetracins E and F, cytotoxic epipolythiodioxopiperazines from the marine-derived fungus Acrostalagmus luteoalbus HDN13-530 RSC Advances 2018 8 (1) 53-58. | ||
|---|---|---|---|
| DOI | 10.1039/c7ra12063j | PMID | - |
