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CHEBI:206719 - Leualacin C

ChEBI IDCHEBI:206719
ChEBI NameLeualacin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H45N3O7
Net Charge0
Average Mass559.704
Monoisotopic Mass559.32575
SMILESCC(C)C[C@@H]1NC(=O)[C@@H](CC(C)C)OC(=O)CCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)OC1=O
InChIInChI=1S/C30H45N3O7/c1-18(2)14-23-30(38)40-25(16-20(5)6)29(37)32-22(17-21-10-8-7-9-11-21)27(35)31-13-12-26(34)39-24(15-19(3)4)28(36)33-23/h7-11,18-20,22-25H,12-17H2,1-6H3,(H,31,35)(H,32,37)(H,33,36)/t22-,23-,24+,25-/m0/s1
InChIKeyPAJNDRQBUAUEIG-JBXUNAHCSA-N
Species of MetaboliteComponentSourceComments
Hapsidospora irregularis (ncbitaxon:95324) - PubMed (28106998)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Leualacin C (CHEBI:206719) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(2R,5S,8S,11S)-11-benzyl-2,5,8-tris(2-methylpropyl)-1,7-dioxa-4,10,13-triazacyclohexadecane-3,6,9,12,16-pentone
Manual XrefsDatabases
76802679ChemSpider