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CHEBI:209574 - Desotamide D

ChEBI IDCHEBI:209574
ChEBI NameDesotamide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H52N8O8
Net Charge0
Average Mass700.838
Monoisotopic Mass700.39081
SMILESCC[C@@H](C)[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)c2ccccc2N)NC(=O)CNC(=O)[C@H](CC(N)=O)NC1=O
InChIInChI=1S/C34H52N8O8/c1-7-19(6)29-34(50)41-25(15-27(36)44)30(46)37-16-28(45)38-24(14-26(43)20-10-8-9-11-21(20)35)32(48)39-22(12-17(2)3)31(47)40-23(13-18(4)5)33(49)42-29/h8-11,17-19,22-25,29H,7,12-16,35H2,1-6H3,(H2,36,44)(H,37,46)(H,38,45)(H,39,48)(H,40,47)(H,41,50)(H,42,49)/t19-,22+,23-,24+,25+,29+/m1/s1
InChIKeyLZYIIJVZWQGRJH-CBHSLMNUSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (25072108)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Desotamide D (CHEBI:209574) is a oligopeptide (CHEBI:25676)
IUPAC Name 
2-[(2S,8S,11S,14R,17S)-8-[2-(2-aminophenyl)-2-oxoethyl]-17-[(2R)-butan-2-yl]-11,14-bis(2-methylpropyl)-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]acetamide
Manual XrefsDatabases
34981599ChemSpider