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Compounds

COMPOUND NPA028606

STRUCTURE
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PROPERTIES
NPAID NPA028606
CLUSTER ID 7432
NODE ID 5083
NAME Luminaolide B
FORMULA C82H142N2O24
MOLECULAR WEIGHT (Da) 1540.0280
ACCURATE MASS (Da) 1538.9953
ORIGIN ORGANISM TYPE Bacterium
ORIGIN GENUS Planktothrix
ORIGIN SPECIES paucivesiculata PCC 9631
InChIKey DOUNUINZQIVRLP-FMWAKIAMSA-N
InChI InChI=1S/C82H142N2O24/c1-47(27-29-67(89)53(7)79(103-19)49(3)31-33-83(13)45-85)77(97)57(11)81-55(9)71(93)43-69(91)51(5)73(101-17)41-63-25-22-24-62(106-63)40-66(100-16)36-60(88)38-76(96)108-82(58(12)78(98)48(2)28-30-68(90)54(8)80(104-20)50(4)32-34-84(14)46-86)56(10)72(94)44-70(92)52(6)74(102-18)42-64-26-21-23-61(105-64)39-65(99-15)35-59(87)37-75(95)107-81/h21-24,31-34,45-66,69-74,77-82,87-88,91-94,97-98H,25-30,35-44H2,1-20H3/b33-31+,34-32+
SMILES COC1CC(O)CC(=O)OC(C(C)C(O)C(C)CCC(=O)C(C)C(OC)C(C)/C=C/N(C)C=O)C(C)C(O)CC(O)C(C)C(OC)CC2CC=CC(CC(OC)CC(O)CC(=O)OC(C(C)C(O)C(C)CCC(=O)C(C)C(OC)C(C)/C=C/N(C)C=O)C(C)C(O)CC(O)C(C)C(OC)CC3CC=CC(C1)O3)O2
ORIGINAL ISOLATION REFERENCE
CITATION Ueoka R; Uria AR; Reiter S; Mori T; Karbaum P; Peters EE; Helfrich EJ; Morinaka BI; Gugger M; Takeyama H; Matsunaga S; Piel J Metabolic and evolutionary origin of actin-binding polyketides from diverse organisms. Nature Chemical Biology 2015 11 (9) 705-712.
DOI 10.1038/nchembio.1870 PMID 26236936
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Bacteria LPSN 2
Phylum Cyanobacteria LPSN 1117
Class Cyanophyceae LPSN -
Order Oscillatoriales LPSN 1150
Family Oscillatoriaceae LPSN 1892254
Genus Planktothrix LPSN 54304
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