Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA016535
PROPERTIES
NPAID | NPA016535 |
---|---|
CLUSTER ID | 514 |
NODE ID | 460 |
NAME | Roseoferin A2 |
FORMULA | C59H108N10O12 |
MOLECULAR WEIGHT (Da) | 1149.5710 |
ACCURATE MASS (Da) | 1148.8148 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Mycogone |
ORIGIN SPECIES | rosea |
InChIKey | GRTPEAVYWFFBJU-UHFFFAOYSA-N |
InChI | InChI=1S/C59H108N10O12/c1-18-21-22-23-24-25-27-39(8)53(78)69-29-26-28-45(69)50(75)62-44(33-37(6)32-43(72)34-42(71)20-3)49(74)61-41(10)48(73)65-57(11,12)55(80)64-46(36(4)5)51(76)63-47(38(7)19-2)52(77)66-59(15,16)56(81)67-58(13,14)54(79)60-40(9)35-68(17)30-31-70/h36-41,43-47,70,72H,18-35H2,1-17H3,(H,60,79)(H,61,74)(H,62,75)(H,63,76)(H,64,80)(H,65,73)(H,66,77)(H,67,81) |
SMILES | CCCCCCCCC(C)C(=O)N1CCCC1C(=O)NC(CC(C)CC(CC(=O)CC)O)C(=O)NC(C)C(=O)NC(C)(C)C(=O)NC(C(C)C)C(=O)NC(C(C)CC)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(C)CN(C)CCO |
ORIGINAL ISOLATION REFERENCE
CITATION | DEGENKOLB, THOMAS; HEINZE, STEPHAN; SCHLEGEL, BRIGITTE; DORNBERGER, KLAUSJÜRGEN; MÖLLMANN, UTE; DAHSE, HANS-MARTIN; GRÄFE, UDO Roseoferin, a New Aminolipopeptide Antibiotic Complex from Mycogone rosea DSM 12973, Structures and Biological Activities Journal of Antibiotics 2000 53 (2) 184-190. | ||
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DOI | 10.7164/antibiotics.53.184 | PMID | 10805580 |