Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019453
PROPERTIES
| NPAID | NPA019453 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | N-Acetyldaunomycin |
| FORMULA | C29H31NO11 |
| MOLECULAR WEIGHT (Da) | 569.5630 |
| ACCURATE MASS (Da) | 569.1897 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | mE130-A4 |
| InChIKey | UCEMIGLIQIYVAH-JEEWRSNPSA-N |
| InChI | InChI=1S/C29H31NO11/c1-11-24(33)16(30-13(3)32)8-19(40-11)41-18-10-29(38,12(2)31)9-15-21(18)28(37)23-22(26(15)35)25(34)14-6-5-7-17(39-4)20(14)27(23)36/h5-7,11,16,18-19,24,33,35,37-38H,8-10H2,1-4H3,(H,30,32)/t11?,16?,18-,19?,24?,29-/m0/s1 |
| SMILES | CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)NC(=O)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | KOMIYAMA, TADAZUMI; MATSUZAWA, YASUE; OKI, TOSHIKAZU; INUI, TAIJI; TAKAHASHI, YOSHIKAZU; NAGANAWA, HIROSHI; TAKEUCHI, TOMIO; UMEZAWA, HAMAO Baumycins, new antitumor antibiotics related to daunomycin Journal of Antibiotics 1977 30 (7) 619-621. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.30.619 | PMID | 561047 |
