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Compounds

COMPOUND NPA018730

STRUCTURE
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PROPERTIES
NPAID NPA018730
CLUSTER ID 2581
NODE ID 2015
NAME Rhizoxin M1
FORMULA C35H49NO9
MOLECULAR WEIGHT (Da) 627.7750
ACCURATE MASS (Da) 627.3407
ORIGIN ORGANISM TYPE Bacterium
ORIGIN GENUS Burkholderia
ORIGIN SPECIES sp.
InChIKey SYVYSCPBRIHWQE-VRAWKDPKSA-N
InChI InChI=1S/C35H49NO9/c1-21(16-27-20-43-25(5)36-27)10-8-11-23(3)34(41)24(4)29-19-30(38)35(6)31(45-35)15-14-22(2)28(37)17-26(18-33(40)42-7)12-9-13-32(39)44-29/h8-11,13-16,20,22,24,26,28-31,34,37-38,41H,12,17-19H2,1-7H3/b10-8+,13-9-,15-14-,21-16+,23-11+/t22-,24+,26-,28?,29?,30+,31-,34+,35?/m1/s1
SMILES C[C@@H]1/C=C\[C@@H]2C(O2)([C@H](CC(OC(=O)/C=C\C[C@H](CC1O)CC(=O)OC)[C@H](C)[C@H](/C(=C/C=C/C(=C/C3=COC(=N3)C)/C)/C)O)O)C
ORIGINAL ISOLATION REFERENCE
CITATION Scherlach, Kirstin; Partida-Martinez, Laila P.; Dahse, Hans-Martin; Hertweck, Christian Antimitotic Rhizoxin Derivatives from a Cultured Bacterial Endosymbiont of the Rice Pathogenic Fungus Rhizopus microsporus Journal of the American Chemical Society 2006 128 (35) 11529-11536.
DOI 10.1021/ja062953o PMID 16939276
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Bacteria LPSN 2
Phylum Proteobacteria LPSN 1224
Class Betaproteobacteria LPSN 28216
Order Burkholderiales LPSN 80840
Family Burkholderiaceae LPSN 119060
Genus Burkholderia LPSN 32008
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