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CHEBI:213475 - Noduliprevenone

ChEBI IDCHEBI:213475
ChEBI NameNoduliprevenone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC33H34O15
Net Charge0
Average Mass670.620
Monoisotopic Mass670.18977
SMILESCOC(=O)CC[C@@H](O)[C@]1(C(=O)OC)CC(=O)c2c(cc(C)c(-c3c(C)cc(O)c4c3O[C@@](C(=O)OC)([C@@H]3CCC(=O)O3)CC4=O)c2O)O1
InChIInChI=1S/C33H34O15/c1-14-10-16(34)26-17(35)13-33(31(42)45-5,21-7-9-23(39)46-21)48-29(26)25(14)24-15(2)11-19-27(28(24)40)18(36)12-32(47-19,30(41)44-4)20(37)6-8-22(38)43-3/h10-11,20-21,34,37,40H,6-9,12-13H2,1-5H3/t20-,21+,32+,33-/m1/s1
InChIKeyKEMIXLHAMVUKQQ-ZVAPWKIXSA-N
Species of MetaboliteComponentSourceComments
Nodulisporiumspecies (ncbitaxon:1897413) - PubMed (18830975)
ChEBI Ontology
Outgoing Relation(s)
Noduliprevenone (CHEBI:213475) has functional parent tetracarboxylic acid (CHEBI:35742)
Noduliprevenone (CHEBI:213475) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
methyl (2R)-5-hydroxy-8-[(2S)-5-hydroxy-2-[(1R)-1-hydroxy-4-methoxy-4-oxobutyl]-2-methoxycarbonyl-7-methyl-4-oxo-3H-chromen-6-yl]-7-methyl-4-oxo-2-[(2S)-5-oxooxolan-2-yl]-3H-chromene-2-carboxylate
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78442777ChemSpider