Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA033255
PROPERTIES
NPAID | NPA033255 |
---|---|
CLUSTER ID | 9583 |
NODE ID | 6410 |
NAME | Nocuolactylate A |
FORMULA | C31H53ClN2O6 |
MOLECULAR WEIGHT (Da) | 585.2260 |
ACCURATE MASS (Da) | 584.3592 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Nodularia |
ORIGIN SPECIES | sp. LEGE 06071 |
InChIKey | ABZLAAWMNHBHEK-GCYRPIBMSA-N |
InChI | InChI=1S/C31H53ClN2O6/c1-4-6-15-19-27-25-28(20-16-7-5-2)40-34(33-27)29(35)22-24-38-31(37)26(3)39-30(36)21-17-13-11-9-8-10-12-14-18-23-32/h13,17,26,28H,4-12,14-16,18-25H2,1-3H3/b17-13+/t26-,28+/m0/s1 |
SMILES | CCCCCC1=NN(C(=O)CCOC(=O)[C@H](C)OC(=O)C/C=C/CCCCCCCCCl)O[C@H](CCCCC)C1 |
ORIGINAL ISOLATION REFERENCE
CITATION | Figueiredo, Sandra A C; Preto, Marco; Moreira, Gabriela; Martins, Teresa P; Abt, Kathleen; Melo, André; Vasconcelos, Vitor M; Leão, Pedro N Discovery of Cyanobacterial Natural Products Containing Fatty Acid Residues*. Angewandte Chemie International Edition 2021 60 (18) 10064-10072. | ||
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DOI | 10.1002/anie.202015105 | PMID | 33599093 |