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CHEBI:222105 - Longicatenamide C

ChEBI IDCHEBI:222105
ChEBI NameLongicatenamide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H54N8O9
Net Charge0
Average Mass742.875
Monoisotopic Mass742.40138
SMILESCC(C)CCC[C@@H]1NC(=O)CNC(=O)[C@@H](Cc2cnc3ccccc23)NC(=O)[C@H]([C@H](O)CC(=O)O)NC(=O)[C@@H](CCCN)NC(=O)[C@H](C(C)C)NC1=O
InChIInChI=1S/C36H54N8O9/c1-19(2)9-7-12-24-33(50)43-30(20(3)4)35(52)41-25(13-8-14-37)34(51)44-31(27(45)16-29(47)48)36(53)42-26(32(49)39-18-28(46)40-24)15-21-17-38-23-11-6-5-10-22(21)23/h5-6,10-11,17,19-20,24-27,30-31,38,45H,7-9,12-16,18,37H2,1-4H3,(H,39,49)(H,40,46)(H,41,52)(H,42,53)(H,43,50)(H,44,51)(H,47,48)/t24-,25+,26+,27+,30-,31-/m0/s1
InChIKeyLDEUYUHPIUIRLG-NKLJQFBCSA-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)
Longicatenamide C (CHEBI:222105) is a oligopeptide (CHEBI:25676)