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CHEBI:7909 - Pandamine

ChEBI IDCHEBI:7909
ChEBI NamePandamine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC31H44N4O5
Net Charge0
Average Mass552.716
Monoisotopic Mass552.33117
SMILESCC[C@H](C)[C@@H](C(=O)N[C@@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)NCC(O)c2ccc(cc2)O[C@H]1C(C)C)N(C)C
InChIInChI=1S/C31H44N4O5/c1-7-20(4)27(35(5)6)31(39)34-26-28(19(2)3)40-23-15-13-22(14-16-23)25(36)18-32-29(37)24(33-30(26)38)17-21-11-9-8-10-12-21/h8-16,19-20,24-28,36H,7,17-18H2,1-6H3,(H,32,37)(H,33,38)(H,34,39)/t20-,24-,25?,26-,27-,28-/m0/s1
InChIKeySTKZKAJIJHJDCQ-CVCFRWPJSA-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)
Pandamine (CHEBI:7909) is a cyclic peptide (CHEBI:23449)
Synonym  Source
PandamineKEGG COMPOUND
Manual XrefsDatabases
C10012KEGG COMPOUND
C00002007KNApSAcK
Registry NumbersSources
CAS:10233-81-5KEGG COMPOUND