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CHEBI:176182 - Squamocin B

ChEBI IDCHEBI:176182
ChEBI NameSquamocin B
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FormulaC35H62O7
Net Charge0
Average Mass594.874
Monoisotopic Mass594.44955
SMILESCCCCCCC(O)CCCC(O)C1CCC(C2CCC(C(O)CCCCCCCCCCC3=CC(C)OC3=O)O2)O1
InChIInChI=1S/C35H62O7/c1-3-4-5-13-17-28(36)18-15-20-30(38)32-22-24-34(42-32)33-23-21-31(41-33)29(37)19-14-11-9-7-6-8-10-12-16-27-25-26(2)40-35(27)39/h25-26,28-34,36-38H,3-24H2,1-2H3
InChIKeyXJTBKNFACRAPEK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Squamocin B (CHEBI:176182) is a polyketide (CHEBI:26188)
IUPAC Name 
4-[11-[5-[5-(1,5-dihydroxyundecyl)oxolan-2-yl]oxolan-2-yl]-11-hydroxyundecyl]-2-methyl-2H-uran-5-one
Manual XrefsDatabases
HMDB0031393HMDB
8802686ChemSpider