Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021323
PROPERTIES
| NPAID | NPA021323 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | FCE 24366 |
| FORMULA | C40H47N3O15 |
| MOLECULAR WEIGHT (Da) | 809.8220 |
| ACCURATE MASS (Da) | 809.3007 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | peucetius var. caesius |
| InChIKey | BJEGYFWQNFXTQG-ODUMSTJCSA-N |
| InChI | InChI=1S/C40H47N3O15/c1-15(44)11-24-55-16(2)31(30-37(50)42(5)39(52)43(6)38(30)51)41-21-12-25(56-17(3)36(21)58-24)57-23-14-40(53,18(4)45)13-20-27(23)35(49)29-28(33(20)47)32(46)19-9-8-10-22(54-7)26(19)34(29)48/h8-10,15-17,21,23-25,30-31,36,41,44,47,49,53H,11-14H2,1-7H3/t15-,16+,17+,21-,23+,24+,25+,31+,36+,40-/m0/s1 |
| SMILES | C[C@@H]1[C@@H]2[C@H](C[C@H](O1)O[C@@H]3C[C@@](CC4=C(C5=C(C(=C34)O)C(=O)C6=C(C5=O)C=CC=C6OC)O)(C(=O)C)O)N[C@H]([C@H](O[C@H](O2)C[C@H](C)O)C)C7C(=O)N(C(=O)N(C7=O)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Cassinelli G; Arlandini E; Ballabio M; Bordoni T; Geroni C; Giuliani F; Grein A; Merli S; Rivola G NEW BIOSYNTHETIC ANTHRACYCLINES RELATED TO BARMINOMYCINS INCORPORATING BARBITURATES IN THEIR MOIETY Journal of Antibiotics 1990 43 (1) 19-28. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.43.19 | PMID | 2307627 |
