Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA008401
PROPERTIES
NPAID | NPA008401 |
---|---|
CLUSTER ID | 2680 |
NODE ID | 2081 |
NAME | Kutzneride 1 |
FORMULA | C37H49Cl2N7O12 |
MOLECULAR WEIGHT (Da) | 854.7420 |
ACCURATE MASS (Da) | 853.2816 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Kutzneria |
ORIGIN SPECIES | sp. 744 |
InChIKey | IAEFGGKMOTXDSA-DGKNJCPKSA-N |
InChI | InChI=1S/C37H49Cl2N7O12/c1-35(2,3)27-32(54)46-19(7-6-12-40-46)29(51)41-18(15-57-5)28(50)42-25(21(47)13-22(48)49)31(53)45-20(30(52)44-26(33(55)58-27)36(4)10-11-36)14-37(56)16-8-9-17(38)23(39)24(16)43-34(37)45/h8-9,18-21,25-27,34,40,43,47,56H,6-7,10-15H2,1-5H3,(H,41,51)(H,42,50)(H,44,52)(H,48,49)/t18-,19-,20-,21-,25+,26-,27+,34-,37+/m0/s1 |
SMILES | CC1(CC1)[C@@H]2C(=O)O[C@H](C(=O)N3[C@@H](CCCN3)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N4[C@@H](C[C@@]5([C@H]4NC6=C5C=CC(=C6Cl)Cl)O)C(=O)N2)[C@H](CC(=O)O)O)COC)C(C)(C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Broberg, Anders; Menkis, Audrius; Vasiliauskas, Rimvydas Kutznerides 1-4, depsipeptides from the actinomycete Kutzneria sp. 744 inhabiting mycorrhizal roots of Picea abies seedlings Journal of Natural Products 2006 69 (1) 97-102. | ||
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DOI | 10.1021/np050378g | PMID | 16441076 |