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CHEBI:209622 - Nobilamide E

ChEBI IDCHEBI:209622
ChEBI NameNobilamide E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H57N7O10
Net Charge0
Average Mass819.957
Monoisotopic Mass819.41669
SMILESC/C=C1\NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)NC(C)=O)[C@@H](C)OC1=O
InChIInChI=1S/C42H57N7O10/c1-9-30-42(58)59-25(7)35(41(57)48-34(23(4)5)40(56)43-24(6)36(52)45-30)49-39(55)33(21-28-15-17-29(51)18-16-28)47-37(53)31(19-22(2)3)46-38(54)32(44-26(8)50)20-27-13-11-10-12-14-27/h9-18,22-25,31-35,51H,19-21H2,1-8H3,(H,43,56)(H,44,50)(H,45,52)(H,46,54)(H,47,53)(H,48,57)(H,49,55)/b30-9-/t24-,25+,31+,32-,33-,34-,35+/m0/s1
InChIKeyAQYCJMOMWLBSIH-JRNPUGJOSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies CN48 (ncbitaxon:1049553) - PubMed (21524089)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Nobilamide E (CHEBI:209622) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(2R)-2-[[(2S)-2-acetamido-3-phenylpropanoyl]amino]-N-[(2S)-1-[[(3Z,6S,9S,12R,13R)-3-ethylidene-6,13-dimethyl-2,5,8,11-tetraoxo-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridec-12-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-4-methylpentanamide
Manual XrefsDatabases
27025557ChemSpider