Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014424
PROPERTIES
| NPAID | NPA014424 |
|---|---|
| CLUSTER ID | 1845 |
| NODE ID | 1490 |
| NAME | Spiroxin A |
| FORMULA | C20H9ClO8 |
| MOLECULAR WEIGHT (Da) | 412.7370 |
| ACCURATE MASS (Da) | 411.9986 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Unknown-fungus |
| ORIGIN SPECIES | sp. strain LL-37H248 |
| InChIKey | BBJLBASQCADFCV-YRYYUTHUSA-N |
| InChI | InChI=1S/C20H9ClO8/c21-5-3-4-10-9(12(5)23)14(25)16-18(27-16)20(10)28-7-2-1-6(22)8-11(7)19(4,29-20)17-15(26-17)13(8)24/h1-3,15-18,22-23H/t15-,16-,17-,18-,19+,20+/m1/s1 |
| SMILES | C1=CC2=C3C(=C1O)C(=O)[C@@H]4[C@H]([C@]35C6=CC(=C(C7=C6[C@](O2)(O5)[C@H]8[C@@H](C7=O)O8)O)Cl)O4 |
ORIGINAL ISOLATION REFERENCE
| CITATION | McDonald, Leonard A.; Abbanat, Darren R.; Barbieri, Laurel R.; Bernan, Valerie S.; Discafani, Carolyn M.; Greenstein, Michael; Janota, Katarzyna; Korshalla, Joseph D.; Lassota, Piotr; Tischler, Mark; Carter, Guy T. Spiroxins, DNA cleaving antitumor antibiotics from a marine-derived fungus Tetrahedron Letters 1999 40 (13) 2489-2492. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(99)00242-7 | PMID | - |
