Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA020127
PROPERTIES
| NPAID | NPA020127 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | R1128 C |
| FORMULA | C19H18O5 |
| MOLECULAR WEIGHT (Da) | 326.3480 |
| ACCURATE MASS (Da) | 326.1154 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. No. 1128 |
| InChIKey | HQIGXKMUTUJEER-UHFFFAOYSA-N |
| InChI | InChI=1S/C19H18O5/c1-9(2)3-4-10-5-11(20)6-13-16(10)19(24)17-14(18(13)23)7-12(21)8-15(17)22/h5-9,20-22H,3-4H2,1-2H3 |
| SMILES | CC(C)CCC1=C2C(=CC(=C1)O)C(=O)C3=CC(=CC(=C3C2=O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hori Y, Takase S, Shigematsu N, Goto T, Okuhara M, Kohsaka M R1128 substances, novel non-steroidal estrogen-receptor antagonists produced by a Streptomyces. II. Physico-chemical properties and structure determination Journal of Antibiotics 1993 46 (7) 1063-1068. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.46.1063 | PMID | 8360100 |
