Loading...

Loading...

Compounds

COMPOUND NPA028579

STRUCTURE
Image structure
EXPORT OPTIONS PNG JSON SDF
PROJECT MOLECULE TO GLOBAL VIEW See Global
EXTERNAL LINKS
npmrd logo unichem logo
PROPERTIES
NPAID NPA028579
CLUSTER ID 8540
NODE ID 516
NAME Incarnatapeptin B
FORMULA C39H63N9O13
MOLECULAR WEIGHT (Da) 865.9830
ACCURATE MASS (Da) 865.4545
ORIGIN ORGANISM TYPE Bacterium
ORIGIN GENUS Streptomyces
ORIGIN SPECIES sp.
InChIKey PPOCPQTXIGARKU-YKLWHMBGSA-N
InChI InChI=1S/C39H63N9O13/c1-19(2)30-29(44-37(56)38(7,57)39-15-14-24(22(5)60-39)23(6)61-39)35(54)47-27(13-10-18-42-47)34(53)48(58)20(3)32(51)46-26(12-9-17-41-46)33(52)45-25(11-8-16-40-45)31(50)43-28(21(4)49)36(55)59-30/h19-30,40-42,49,57-58H,8-18H2,1-7H3,(H,43,50)(H,44,56)/t20-,21+,22+,23+,24?,25-,26+,27+,28-,29-,30-,38+,39?/m0/s1
SMILES CC(C)[C@@H]1OC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H]2CCCNN2C(=O)[C@H]2CCCNN2C(=O)[C@H](C)N(O)C(=O)[C@H]2CCCNN2C(=O)[C@H]1NC(=O)[C@@](C)(O)C12CCC([C@@H](C)O1)[C@@H](C)O2
ORIGINAL ISOLATION REFERENCE
CITATION Morgan KD; Williams DE; Patrick BO; Remigy M; Banuelos CA; Sadar MD; Ryan KS; Andersen RJ Incarnatapeptins A and B, Nonribosomal Peptides Discovered Using Genome Mining and 1H/15N HSQC-TOCSY. Organic Letters 2020 22 (11) 4053-4057.
DOI 10.1021/acs.orglett.0c00818 PMID 32283033
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
CLASSYFIRE
Show Hide
NP CLASSIFIER
Show Hide