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CHEBI:213103 - Tasiamid C

ChEBI IDCHEBI:213103
ChEBI NameTasiamid C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H64N6O11
Net Charge0
Average Mass816.994
Monoisotopic Mass816.46331
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)N(C)C(=O)[C@H](OC(=O)[C@@H](O)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC
InChIInChI=1S/C41H64N6O11/c1-11-25(6)32(44-35(50)28(19-20-31(42)48)45(8)39(54)34(24(4)5)58-41(56)33(49)23(2)3)36(51)43-26(7)37(52)46(9)30(22-27-16-13-12-14-17-27)38(53)47-21-15-18-29(47)40(55)57-10/h12-14,16-17,23-26,28-30,32-34,49H,11,15,18-22H2,1-10H3,(H2,42,48)(H,43,51)(H,44,50)/t25-,26-,28-,29-,30+,32-,33-,34+/m0/s1
InChIKeyAHQNKBYNGPOOJC-MQGPFOMQSA-N
Species of MetaboliteComponentSourceComments
Symploca (ncbitaxon:105591) - PubMed (24588245)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Tasiamid C (CHEBI:213103) is a depsipeptide (CHEBI:23643)
IUPAC Name 
methyl (2S)-1-[(2R)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[(2R)-2-[(2S)-2-hydroxy-3-methylbutanoyl]oxy-3-methylbutanoyl]-methylamino]-5-oxopentanoyl]amino]-3-methylpentanoyl]amino]propanoyl]-methylamino]-3-phenylpropanoyl]pyrrolidine-2-carboxylate