Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001233
PROPERTIES
| NPAID | NPA001233 |
|---|---|
| CLUSTER ID | 105 |
| NODE ID | 100 |
| NAME | Squalestatin H1 |
| FORMULA | C25H30O12 |
| MOLECULAR WEIGHT (Da) | 522.5030 |
| ACCURATE MASS (Da) | 522.1737 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Phoma |
| ORIGIN SPECIES | sp. C2932 |
| InChIKey | LXSZCAUKBBTSFP-NFQMRGDASA-N |
| InChI | InChI=1S/C25H30O12/c1-13(18(35-15(3)26)14(2)11-16-7-5-4-6-8-16)9-10-24-17(27)12-23(37-24,21(30)31)25(34,22(32)33)19(36-24)20(28)29/h4-8,14,17-19,27,34H,1,9-12H2,2-3H3,(H,28,29)(H,30,31)(H,32,33)/t14-,17-,18-,19-,23+,24+,25-/m1/s1 |
| SMILES | C[C@H](CC1=CC=CC=C1)[C@@H](C(=C)CC[C@@]23[C@@H](C[C@@](O2)([C@@]([C@H](O3)C(=O)O)(C(=O)O)O)C(=O)O)O)OC(=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Blows; Foster; Lane; Noble; Piercey; Sidebottom; Webb The squalestatins, novel inhibitors of squalene synthase produced by a species of Phoma. V. Minor metabolites Journal of Antibiotics 1994 47 (7) 740-754. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.47.740 | PMID | 8071119 |
