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CHEBI:175122 - Nigakihemiacetal B

ChEBI IDCHEBI:175122
ChEBI NameNigakihemiacetal B
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SubmitterMetaboLights
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FormulaC22H30O6
Net Charge0
Average Mass390.476
Monoisotopic Mass390.20424
SMILESCOC1=CC(C)C2CC3OC(O)CC4C(C)=C(OC)C(=O)C(C2(C)C1=O)C34C
InChIInChI=1S/C22H30O6/c1-10-7-14(26-5)20(25)22(4)12(10)8-15-21(3)13(9-16(23)28-15)11(2)18(27-6)17(24)19(21)22/h7,10,12-13,15-16,19,23H,8-9H2,1-6H3
InChIKeyBDQNCUODBJZKIY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Nigakihemiacetal B (CHEBI:175122) is a quassinoid (CHEBI:72485)
IUPAC Name 
11-hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,16-dione
Manual XrefsDatabases
HMDB0035922HMDB
250123ChemSpider
LMPR01060017LIPID MAPS
C08771KEGG COMPOUND