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CHEBI:188044 - Malyngamide H

ChEBI IDCHEBI:188044
ChEBI NameMalyngamide H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H41NO4
Net Charge0
Average Mass431.617
Monoisotopic Mass431.30356
SMILES[H][C@@]12CC=C(C)C(=O)[C@]1(C(=C)CCNC(=O)CC/C=C/C[C@H](CCCCCCC)OC)O2
InChIInChI=1S/C26H41NO4/c1-5-6-7-8-10-13-22(30-4)14-11-9-12-15-24(28)27-19-18-21(3)26-23(31-26)17-16-20(2)25(26)29/h9,11,16,22-23H,3,5-8,10,12-15,17-19H2,1-2,4H3,(H,27,28)/b11-9+/t22-,23+,26+/m0/s1
InChIKeyMNBBBIJBVPWYSD-AIIVTHQSSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
Malyngamide H (CHEBI:188044) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(E,7S)-7-methoxy-N-[3-[(1R,6R)-3-methyl-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]but-3-enyl]tetradec-4-enamide
Manual XrefsDatabases
8201342ChemSpider