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CHEBI:225426 - Moriniafungin F

ChEBI IDCHEBI:225426
ChEBI NameMoriniafungin F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC37H54O13
Net Charge0
Average Mass706.826
Monoisotopic Mass706.35644
SMILESCO[C@@H]1[C@@H](C)O[C@@H](OC[C@@]23C[C@@H]4[C@H](C)CC[C@H]4[C@@]4(C(=O)O)C[C@@H]2C=C(C(C)C)[C@@]34C(=O)O)[C@@H](O)[C@@]12OC(=O)[C@H](CCCCCCCC(=O)O)O2
InChIInChI=1S/C37H54O13/c1-19(2)25-15-22-16-35(32(42)43)24-14-13-20(3)23(24)17-34(22,36(25,35)33(44)45)18-47-31-28(40)37(29(46-5)21(4)48-31)49-26(30(41)50-37)11-9-7-6-8-10-12-27(38)39/h15,19-24,26,28-29,31,40H,6-14,16-18H2,1-5H3,(H,38,39)(H,42,43)(H,44,45)/t20-,21-,22+,23-,24-,26+,28-,29-,31-,34+,35-,36-,37-/m1/s1
InChIKeyAPMMEDCBRAXORN-LNXQFXEOSA-N
Species of MetaboliteComponentSourceComments
Curvularia (ncbitaxon:5502) - PubMed (31478377)
ChEBI Ontology
Outgoing Relation(s)
Moriniafungin F (CHEBI:225426) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(1R,2S,4R,5R,8R,9S,11R)-2-[[(2S,5R,6R,7R,9R,10R)-2-(7-carboxyheptyl)-10-hydroxy-6-methoxy-7-methyl-3-oxo-1,4,8-trioxaspiro[4.5]decan-9-yl]oxymethyl]-5-methyl-13-propan-2-yltetracyclo[7.4.0.02,11.04,8]tridec-12-ene-1,9-dicarboxylic acid
Manual XrefsDatabases
81360767ChemSpider