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CHEBI:219648 - Trichorozin-III

ChEBI IDCHEBI:219648
ChEBI NameTrichorozin-III
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC58H102N12O13
Net Charge0
Average Mass1175.525
Monoisotopic Mass1174.76893
SMILESCCC(C)C(NC(=O)C(CC(N)=O)NC(=O)C(C)(C)NC(C)=O)C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(CO)CC(C)C)C(C)CC
InChIInChI=1S/C58H102N12O13/c1-18-34(9)44(64-46(74)40(29-43(59)73)63-53(81)56(12,13)66-36(11)72)51(79)61-38(27-32(5)6)47(75)68-58(16,17)55(83)70-25-21-23-42(70)50(78)65-45(35(10)19-2)52(80)62-39(28-33(7)8)48(76)67-57(14,15)54(82)69-24-20-22-41(69)49(77)60-37(30-71)26-31(3)4/h31-35,37-42,44-45,71H,18-30H2,1-17H3,(H2,59,73)(H,60,77)(H,61,79)(H,62,80)(H,63,81)(H,64,74)(H,65,78)(H,66,72)(H,67,76)(H,68,75)
InChIKeyUIALEXQSXHTTRA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Trichoderma harzianum (ncbitaxon:5544) - PubMed (7539721)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Trichorozin-III (CHEBI:219648) is a polypeptide (CHEBI:15841)
IUPAC Name 
2-[(2-acetamido-2-methylpropanoyl)amino]-N-[1-[[1-[[1-[2-[[1-[[1-[[1-[2-[(1-hydroxy-4-methylpentan-2-yl)carbamoyl]pyrrolidin-1-yl]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]butanediamide
Manual XrefsDatabases
78444204ChemSpider