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Compounds

COMPOUND NPA023831

STRUCTURE
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PROPERTIES
NPAID NPA023831
CLUSTER ID 579
NODE ID 516
NAME Dentigerumycin B
FORMULA C39H65N9O14
MOLECULAR WEIGHT (Da) 883.9980
ACCURATE MASS (Da) 883.4651
ORIGIN ORGANISM TYPE Bacterium
ORIGIN GENUS Streptomyces
ORIGIN SPECIES sp. M41
InChIKey LIDQMIXLFKMPRJ-ALHWGSAKSA-N
InChI InChI=1S/C39H65N9O14/c1-7-23-15-16-39(58,62-27(23)8-2)38(6,57)37(56)43-29-31(21(3)4)61-36(55)30(22(5)49)48(60)34(53)26-14-11-18-41-46(26)33(52)25-13-10-17-40-45(25)28(50)20-44(59)32(51)24-12-9-19-42-47(24)35(29)54/h21-27,29-31,40-42,49,57-60H,7-20H2,1-6H3,(H,43,56)/t22-,23-,24+,25+,26-,27+,29-,30+,31-,38+,39+/m0/s1
SMILES CC[C@H]1CC[C@@](O[C@@H]1CC)([C@@](C)(C(=O)N[C@H]2[C@@H](OC(=O)[C@H](N(C(=O)[C@@H]3CCCNN3C(=O)[C@H]4CCCNN4C(=O)CN(C(=O)[C@H]5CCCNN5C2=O)O)O)[C@H](C)O)C(C)C)O)O
ORIGINAL ISOLATION REFERENCE
CITATION Wyche, Thomas P.; Ruzzini, Antonio C.; Beemelmanns, Christine; Kim, Ki Hyun; Klassen, Jonathan L.; Cao, Shugeng; Poulsen, Michael; Bugni, Tim S.; Currie, Cameron R.; Clardy, Jon Linear Peptides Are the Major Products of a Biosynthetic Pathway That Encodes for Cyclic Depsipeptides Organic Letters 2017 19 (7) 1772-1775.
DOI 10.1021/acs.orglett.7b00545 PMID 28326787
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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