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CHEBI:219164 - Macyranone F

ChEBI IDCHEBI:219164
ChEBI NameMacyranone F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC33H41N5O9
Net Charge0
Average Mass651.717
Monoisotopic Mass651.29043
SMILESCCC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O
InChIInChI=1S/C33H41N5O9/c1-4-27(41)24(15-21-16-34-23-13-9-8-12-22(21)23)35-31(44)26(17-39)37-32(45)28(19(3)40)38-30(43)18(2)29(42)36-25(33(46)47)14-20-10-6-5-7-11-20/h5-13,16,18-19,24-26,28,34,39-40H,4,14-15,17H2,1-3H3,(H,35,44)(H,36,42)(H,37,45)(H,38,43)(H,46,47)/t18?,19-,24+,25+,26+,28+/m1/s1
InChIKeyKRIOFTHWUQTAOK-NELHGDMNSA-N
Species of MetaboliteComponentSourceComments
Cystobacter (ncbitaxon:42) - PubMed (26050527)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Macyranone F (CHEBI:219164) is a peptide (CHEBI:16670)
IUPAC Name 
(2S)-2-[[3-[[(2S,3R)-3-hydroxy-1-[[(2S)-3-hydroxy-1-[[(2S)-1-(1H-indol-3-yl)-3-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-2-methyl-3-oxopropanoyl]amino]-3-phenylpropanoic acid
Manual XrefsDatabases
58825844ChemSpider