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CHEBI:223361 - Amycolatomycin A

ChEBI IDCHEBI:223361
ChEBI NameAmycolatomycin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H50Cl2N8O9
Net Charge0
Average Mass869.804
Monoisotopic Mass868.30778
SMILESCC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2c(Cl)nc3cc(Cl)ccc23)NC(=O)[C@@H](Cc2cnc3ccccc23)NC(=O)[C@@H](C(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(=O)O)NC1=O
InChIInChI=1S/C41H50Cl2N8O9/c1-5-20(4)34-41(60)46-27(12-13-32(53)54)36(55)49-31(18-52)39(58)50-33(19(2)3)40(59)48-29(14-21-17-44-26-9-7-6-8-23(21)26)37(56)47-30(38(57)51-34)16-25-24-11-10-22(42)15-28(24)45-35(25)43/h6-11,15,17,19-20,27,29-31,33-34,44-45,52H,5,12-14,16,18H2,1-4H3,(H,46,60)(H,47,56)(H,48,59)(H,49,55)(H,50,58)(H,51,57)(H,53,54)/t20-,27+,29+,30+,31-,33+,34-/m0/s1
InChIKeyHBIPRXPUUKAVEZ-VANMHSFDSA-N
Species of MetaboliteComponentSourceComments
Amycolatopsisspecies (ncbitaxon:37632) - PubMed (33807584)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Amycolatomycin A (CHEBI:223361) is a oligopeptide (CHEBI:25676)