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CHEBI:9246 - Squamocin

ChEBI IDCHEBI:9246
ChEBI NameSquamocin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC37H66O7
Net Charge0
Average Mass622.928
Monoisotopic Mass622.48085
SMILES[H][C@]1([C@H](O)CCCCCCCCCCCCC2=C[C@H](C)OC2=O)CC[C@]([H])([C@@]2([H])CC[C@]([H])([C@@H](O)CCC[C@@H](O)CCCCCC)O2)O1
InChIInChI=1S/C37H66O7/c1-3-4-5-15-19-30(38)20-17-22-32(40)34-24-26-36(44-34)35-25-23-33(43-35)31(39)21-16-13-11-9-7-6-8-10-12-14-18-29-27-28(2)42-37(29)41/h27-28,30-36,38-40H,3-26H2,1-2H3/t28-,30-,31+,32-,33+,34+,35+,36+/m0/s1
InChIKeyDAEFUOXKPZLQMM-AUDZWCKFSA-N
ChEBI Ontology
Outgoing Relation(s)
Squamocin (CHEBI:9246) is a polyketide (CHEBI:26188)
Synonym  Source
SquamocinKEGG COMPOUND
Manual XrefsDatabases
C08545KEGG COMPOUND
C00001323KNApSAcK
Registry NumbersSources
CAS:120298-30-8KEGG COMPOUND