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Compounds

COMPOUND NPA008584

STRUCTURE
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PROPERTIES
NPAID NPA008584
CLUSTER ID 242
NODE ID 222
NAME Milbemycin α29
FORMULA C43H59NO12
MOLECULAR WEIGHT (Da) 781.9400
ACCURATE MASS (Da) 781.4037
ORIGIN ORGANISM TYPE Bacterium
ORIGIN GENUS Streptomyces
ORIGIN SPECIES bingchenggensis
InChIKey XSHPBAFYEVNLOX-NLUCSBGGSA-N
InChI InChI=1S/C43H59NO12/c1-23(2)16-26(5)39(47)54-36-27(6)28(7)55-42(37(36)46)20-32-19-31(56-42)14-13-25(4)17-24(3)10-8-11-30-22-51-38-35(45)29(18-33(40(48)53-32)43(30,38)50)21-52-41(49)34-12-9-15-44-34/h8-13,15,18,23-24,26-28,31-33,35-38,44-46,50H,14,16-17,19-22H2,1-7H3/b10-8-,25-13-,30-11-/t24-,26?,27+,28+,31+,32-,33-,35+,36-,37+,38+,42+,43+/m0/s1
SMILES C[C@@H]\1C/C(=C\C[C@@H]2C[C@@H](C[C@@]3(O2)[C@@H]([C@H]([C@@H]([C@H](O3)C)C)OC(=O)C(C)CC(C)C)O)OC(=O)[C@@H]4C=C([C@H]([C@@H]5[C@]4(/C(=C\C=C1)/CO5)O)O)COC(=O)C6=CC=CN6)/C
ORIGINAL ISOLATION REFERENCE
CITATION Xiang, Wen-Sheng; Wang, Ji-Dong; Wang, Xiang-Jing; Zhang, Ji; Wang, Ze Further New Milbemycin Antibiotics from Streptomyces bingchenggensis Journal of Antibiotics 2007 60 (10) 608-613.
DOI 10.1038/ja.2007.78 PMID 17965476
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Bacteria LPSN 2
Phylum Actinobacteria LPSN 201174
Class Actinobacteria LPSN -
Order Streptomycetales LPSN 85011
Family Streptomycetaceae LPSN 2062
Genus Streptomyces LPSN 1883
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