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CHEBI:2680 - Amphibine A

ChEBI IDCHEBI:2680
ChEBI NameAmphibine A
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC33H43N5O4
Net Charge0
Average Mass573.738
Monoisotopic Mass573.33150
SMILES[H][C@@]1([C@@H](C)CC)NC(=O)[C@@H](NC(=O)[C@H](Cc2cnc3ccccc23)N(C)C)[C@H](C(C)C)Oc2ccc(cc2)/C=C\NC1=O
InChIInChI=1S/C33H43N5O4/c1-7-21(4)28-32(40)34-17-16-22-12-14-24(15-13-22)42-30(20(2)3)29(33(41)36-28)37-31(39)27(38(5)6)18-23-19-35-26-11-9-8-10-25(23)26/h8-17,19-21,27-30,35H,7,18H2,1-6H3,(H,34,40)(H,36,41)(H,37,39)/b17-16-/t21-,27-,28-,29-,30-/m0/s1
InChIKeyZNUMAFXIQXNMMH-UZFRKIFNSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Amphibine A (CHEBI:2680) is a cyclic peptide (CHEBI:23449)
Synonym  Source
Amphibine AKEGG COMPOUND
Manual XrefsDatabases
C09997KEGG COMPOUND
C00001992KNApSAcK
Registry NumbersSources
CAS:36535-97-4KEGG COMPOUND