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CHEBI:219345 - Xeneprotide C

ChEBI IDCHEBI:219345
ChEBI NameXeneprotide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H38N6O6
Net Charge0
Average Mass626.714
Monoisotopic Mass626.28528
SMILESCCC(=O)N[C@@H]1C(=O)N[C@@H](Cc2cnc3ccccc23)C(=O)N[C@H](Cc2cnc3ccccc23)C(=O)N2CCC[C@H]2C(=O)O[C@@H]1C
InChIInChI=1S/C34H38N6O6/c1-3-29(41)39-30-19(2)46-34(45)28-13-8-14-40(28)33(44)27(16-21-18-36-25-12-7-5-10-23(21)25)38-31(42)26(37-32(30)43)15-20-17-35-24-11-6-4-9-22(20)24/h4-7,9-12,17-19,26-28,30,35-36H,3,8,13-16H2,1-2H3,(H,37,43)(H,38,42)(H,39,41)/t19-,26+,27-,28+,30+/m1/s1
InChIKeyYNNVIZAKAVCBIS-MEUYHONQSA-N
Species of MetaboliteComponentSourceComments
Xenorhabdusspecies (ncbitaxon:51785) - PubMed (28993611)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Xeneprotide C (CHEBI:219345) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
N-[(3R,6S,9S,10R,13S)-3,6-bis(1H-indol-3-ylmethyl)-10-methyl-2,5,8,12-tetraoxo-11-oxa-1,4,7-triazabicyclo[11.3.0]hexadecan-9-yl]propanamide