Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA014368
PROPERTIES
NPAID | NPA014368 |
---|---|
CLUSTER ID | 368 |
NODE ID | 332 |
NAME | Chrondramide 11 |
FORMULA | C42H53ClN4O13 |
MOLECULAR WEIGHT (Da) | 857.3540 |
ACCURATE MASS (Da) | 856.3298 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Chondromyces |
ORIGIN SPECIES | sp. MSr9030 |
InChIKey | UXIQKNXCZYRPHW-QULXLUQGSA-N |
InChI | InChI=1S/C42H53ClN4O13/c1-19-14-20(2)23(5)58-41(56)35(57-7)32(24-12-13-30(27(43)16-24)59-42-31(39(53)54)33(48)34(49)40(55)60-42)46-37(51)29(17-25-18-44-28-11-9-8-10-26(25)28)47(6)38(52)22(4)45-36(50)21(3)15-19/h8-14,16,18,20-23,29,31-35,40,42,44,48-49,55H,15,17H2,1-7H3,(H,45,50)(H,46,51)(H,53,54)/b19-14-/t20-,21-,22-,23+,29+,31?,32?,33?,34?,35-,40?,42?/m0/s1 |
SMILES | C[C@H]1C/C(=C\[C@@H]([C@H](OC(=O)[C@H](C(NC(=O)[C@H](N(C(=O)[C@@H](NC1=O)C)C)CC2=CNC3=CC=CC=C32)C4=CC(=C(C=C4)OC5C(C(C(C(O5)O)O)O)C(=O)O)Cl)OC)C)C)/C |
ORIGINAL ISOLATION REFERENCE
CITATION | Herrmann, Jennifer; Hüttel, Stephan; Müller, Rolf Discovery and Biological Activity of New Chondramides from Chondromyces sp ChemBioChem 2013 14 (13) 1573-1580. | ||
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DOI | 10.1002/cbic.201300140 | PMID | 23959765 |