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CHEBI:225276 - Desotamide C

ChEBI IDCHEBI:225276
ChEBI NameDesotamide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H52N8O9
Net Charge0
Average Mass728.848
Monoisotopic Mass728.38573
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)c2ccccc2NC=O)NC(=O)CNC(=O)[C@H](CC(N)=O)NC1=O
InChIInChI=1S/C35H52N8O9/c1-7-20(6)30-35(52)42-26(15-28(36)46)31(48)37-16-29(47)39-25(14-27(45)21-10-8-9-11-22(21)38-17-44)33(50)40-23(12-18(2)3)32(49)41-24(13-19(4)5)34(51)43-30/h8-11,17-20,23-26,30H,7,12-16H2,1-6H3,(H2,36,46)(H,37,48)(H,38,44)(H,39,47)(H,40,50)(H,41,49)(H,42,52)(H,43,51)/t20-,23+,24-,25+,26+,30+/m1/s1
InChIKeyXENNYMYVTODMIJ-KDFWMOTESA-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 C (CHEBI:225276) is a oligopeptide (CHEBI:25676)
IUPAC Name 
2-[(2S,8S,11S,14R,17S)-17-[(2R)-butan-2-yl]-8-[2-(2-ormamidophenyl)-2-oxoethyl]-11,14-bis(2-methylpropyl)-3,6,9,12,15,18-hexaoxo-1,4,7,10,13,16-hexazacyclooctadec-2-yl]acetamide
Manual XrefsDatabases
34981606ChemSpider