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CHEBI:216853 - Trichodecenin-II

ChEBI IDCHEBI:216853
ChEBI NameTrichodecenin-II
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H69N7O8
Net Charge0
Average Mass752.011
Monoisotopic Mass751.52076
SMILESCCCCC/C=C\CCC(=O)NCC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NC(C)(C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CO)CC(C)C
InChIInChI=1S/C38H69N7O8/c1-10-11-12-13-14-15-16-17-31(47)39-21-32(48)40-22-33(49)44-30(20-27(6)7)36(52)45-38(8,9)37(53)41-23-34(50)43-29(19-26(4)5)35(51)42-28(24-46)18-25(2)3/h14-15,25-30,46H,10-13,16-24H2,1-9H3,(H,39,47)(H,40,48)(H,41,53)(H,42,51)(H,43,50)(H,44,49)(H,45,52)/b15-14-/t28-,29-,30-/m0/s1
InChIKeyNWZRAGOZRFZRMT-DXQOOLMCSA-N
Species of MetaboliteComponentSourceComments
Trichoderma viride (ncbitaxon:5547) - PubMed (8004694)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Trichodecenin-II (CHEBI:216853) is a oligopeptide (CHEBI:25676)
IUPAC Name 
(Z)-N-[2-[[2-[[(2S)-1-[[1-[[2-[[(2S)-1-[[(2S)-1-hydroxy-4-methylpentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]dec-4-enamide
Manual XrefsDatabases
8548348ChemSpider