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CHEBI:227922 - Oryzamide B

ChEBI IDCHEBI:227922
ChEBI NameOryzamide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H57N5O8
Net Charge0
Average Mass687.879
Monoisotopic Mass687.42071
SMILESCCCCCC[C@H](C)[C@@H]1CC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)O1
InChIInChI=1S/C36H57N5O8/c1-8-9-10-11-12-23(6)29-19-30(43)37-20-31(44)41-32(22(4)5)35(47)39-27(17-21(2)3)34(46)38-24(7)33(45)40-28(36(48)49-29)18-25-13-15-26(42)16-14-25/h13-16,21-24,27-29,32,42H,8-12,17-20H2,1-7H3,(H,37,43)(H,38,46)(H,39,47)(H,40,45)(H,41,44)/t23-,24-,27+,28-,29-,32-/m0/s1
InChIKeyCKGVVIAXAMPILO-PIQMYNCNSA-N
Species of MetaboliteComponentSourceComments
Nigrospora (ncbitaxon:114230) - PubMed (27489998)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Oryzamide B (CHEBI:227922) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(3S,6S,9R,12S,19S)-3-[(4-hydroxyphenyl)methyl]-6-methyl-9-(2-methylpropyl)-19-[(2S)-octan-2-yl]-12-propan-2-yl-1-oxa-4,7,10,13,16-pentazacyclononadecane-2,5,8,11,14,17-hexone
Manual XrefsDatabases
58197182ChemSpider