Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004214
PROPERTIES
| NPAID | NPA004214 |
|---|---|
| CLUSTER ID | 2217 |
| NODE ID | 1763 |
| NAME | Not named |
| FORMULA | C32H22O8 |
| MOLECULAR WEIGHT (Da) | 534.5200 |
| ACCURATE MASS (Da) | 534.1315 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. N1-78-1 |
| InChIKey | YDMUHLKWZINQFC-MFHOVDBWSA-N |
| InChI | InChI=1S/C32H22O8/c1-12-9-16-22(20(34)10-12)28(37)23-15(27(16)36)7-8-18-30(23)40-32-17-5-4-6-19(33)24(17)29(38)26-21(35)11-13(2)25(14(3)39-32)31(18,26)32/h4-11,14,25,33-34,38H,1-3H3/t14-,25-,31?,32+/m0/s1 |
| SMILES | C[C@H]1[C@@H]2C(=CC(=O)C3=C(C4=C(C=CC=C4O)[C@@]5(C23C6=C(O5)C7=C(C=C6)C(=O)C8=CC(=CC(=C8C7=O)O)C)O1)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Socha, Aaron M.; Garcia, Dioscaris; Sheffer, Roberta; Rowley, David C. Antibiotic bisanthraquinones produced by a streptomycete isolated from a cyanobacterium associated with Ecteinascidia turbinata Journal of Natural Products 2006 69 (7) 1070-1073. | ||
|---|---|---|---|
| DOI | 10.1021/np050449b | PMID | 16872146 |
