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CHEBI:47550 - (5E)-14-chloro-15,17-dihydroxy-4,7,8,9,10,11-hexahydro-2-benzoxacyclopentadecine-1,12(3H,13H)-dione

Default Structure
ChEBI IDCHEBI:47550
ChEBI Name(5E)-14-chloro-15,17-dihydroxy-4,7,8,9,10,11-hexahydro-2-benzoxacyclopentadecine-1,12(3H,13H)-dione
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DownloadsMolfile
FormulaC18H21ClO5
Net Charge0
Average Mass352.814
Monoisotopic Mass352.10775
SMILES[H]Oc1c([H])c(O[H])c2c(c1Cl)C([H])([H])C(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])/C([H])=C(\[H])C([H])([H])C([H])([H])OC2=O
InChIInChI=1S/C18H21ClO5/c19-17-13-10-12(20)8-6-4-2-1-3-5-7-9-24-18(23)16(13)14(21)11-15(17)22/h3,5,11,21-22H,1-2,4,6-10H2/b5-3+
InChIKeyVZTAZMSAAIUZJV-HWKANZROSA-N
ChEBI Ontology
Outgoing Relation(s)
(5E)-14-chloro-15,17-dihydroxy-4,7,8,9,10,11-hexahydro-2-benzoxacyclopentadecine-1,12(3H,13H)-dione (CHEBI:47550) is a unclassifieds (CHEBI:27189)
Synonym  Source
(5E)-14-chloro-15,17-dihydroxy-4,7,8,9,10,11-hexahydro-2-benzoxacyclopentadecine-1,12(3H,13H)-dionePDBeChem
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