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CHEBI:222872 - Amychelin B

ChEBI IDCHEBI:222872
ChEBI NameAmychelin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H44N8O15
Net Charge0
Average Mass756.723
Monoisotopic Mass756.29261
SMILESO=CN(O)CCC[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H]1COC(c2ccccc2O)=N1)C(=O)N[C@H](CCCNO)C(=O)O
InChIInChI=1S/C30H44N8O15/c39-11-19(25(45)32-17(7-4-10-38(52)15-42)24(44)33-18(30(49)50)6-3-9-31-51)34-26(46)20(12-40)35-27(47)21(13-41)36-28(48)22-14-53-29(37-22)16-5-1-2-8-23(16)43/h1-2,5,8,15,17-22,31,39-41,43,51-52H,3-4,6-7,9-14H2,(H,32,45)(H,33,44)(H,34,46)(H,35,47)(H,36,48)(H,49,50)/t17-,18-,19+,20-,21+,22-/m1/s1
InChIKeyBHWUAJFEXZMNJT-OVQJPPBNSA-N
Species of MetaboliteComponentSourceComments
Amycolatopsisspecies AA4 (ncbitaxon:1896961) - PubMed (21699219)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Amychelin B (CHEBI:222872) is a polypeptide (CHEBI:15841)