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CHEBI:224880 - Ahpatinin F

ChEBI IDCHEBI:224880
ChEBI NameAhpatinin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H61N5O9
Net Charge0
Average Mass719.921
Monoisotopic Mass719.44693
SMILESCC(C)CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](CC(C)C)[C@@H](O)CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)[C@H](O)CC(=O)O)C(C)C)c1ccccc1
InChIInChI=1S/C37H61N5O9/c1-20(2)15-26(28(43)18-31(46)38-24(9)35(49)39-27(16-21(3)4)29(44)19-32(47)48)40-36(50)33(23(7)8)42-37(51)34(25-13-11-10-12-14-25)41-30(45)17-22(5)6/h10-14,20-24,26-29,33-34,43-44H,15-19H2,1-9H3,(H,38,46)(H,39,49)(H,40,50)(H,41,45)(H,42,51)(H,47,48)/t24-,26+,27-,28-,29+,33-,34-/m0/s1
InChIKeyMRXGDZORFRGURD-NRTIAEHWSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (3093433)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Ahpatinin F (CHEBI:224880) is a peptide (CHEBI:16670)
IUPAC Name 
(3R,4S)-3-hydroxy-4-[[(2S)-2-[[(3S,4R)-3-hydroxy-6-methyl-4-[[(2S)-3-methyl-2-[[(2S)-2-(3-methylbutanoylamino)-2-phenylacetyl]amino]butanoyl]amino]heptanoyl]amino]propanoyl]amino]-6-methylheptanoic acid
Manual XrefsDatabases
78443264ChemSpider