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CHEBI:225430 - Moriniafungin G

ChEBI IDCHEBI:225430
ChEBI NameMoriniafungin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H56O13
Net Charge0
Average Mass720.853
Monoisotopic Mass720.37209
SMILESCOC(=O)CCCCCCC[C@@H]1O[C@@]2(OC1=O)[C@H](O)[C@H](OC[C@@]13C[C@@H]4[C@H](C)CC[C@H]4[C@@]4(C(=O)O)C[C@@H]1C=C(C(C)C)[C@@]34C(=O)O)O[C@H](C)[C@H]2OC
InChIInChI=1S/C38H56O13/c1-20(2)26-16-23-17-36(33(42)43)25-15-14-21(3)24(25)18-35(23,37(26,36)34(44)45)19-48-32-29(40)38(30(47-6)22(4)49-32)50-27(31(41)51-38)12-10-8-7-9-11-13-28(39)46-5/h16,20-25,27,29-30,32,40H,7-15,17-19H2,1-6H3,(H,42,43)(H,44,45)/t21-,22-,23+,24-,25-,27+,29-,30-,32-,35+,36-,37-,38-/m1/s1
InChIKeyVINWBMDOZUDNHR-PLSVBXRVSA-N
Species of MetaboliteComponentSourceComments
Curvularia (ncbitaxon:5502) - PubMed (31478377)
ChEBI Ontology
Outgoing Relation(s)
Moriniafungin G (CHEBI:225430) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(1R,2S,4R,5R,8R,9S,11R)-2-[[(2S,5R,6R,7R,9R,10R)-10-hydroxy-6-methoxy-2-(8-methoxy-8-oxooctyl)-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
81360768ChemSpider