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CHEBI:181055 - methyl (4S,5R,9R,13R)-16-hydroxy-5,9-dimethyl-10,14-dioxotricyclo[11.2.1.04,9]hexadec-1(15)-ene-5-carboxylate

ChEBI IDCHEBI:181055
ChEBI Namemethyl (4S,5R,9R,13R)-16-hydroxy-5,9-dimethyl-10,14-dioxotricyclo[11.2.1.04,9]hexadec-1(15)-ene-5-carboxylate
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FormulaC20H28O5
Net Charge0
Average Mass348.439
Monoisotopic Mass348.19367
SMILES[H][C@]12CCC3=CC(=O)[C@]([H])(CCC(=O)[C@]1(C)CCC[C@@]2(C)C(=O)OC)C3O
InChIInChI=1S/C20H28O5/c1-19-9-4-10-20(2,18(24)25-3)15(19)7-5-12-11-14(21)13(17(12)23)6-8-16(19)22/h11,13,15,17,23H,4-10H2,1-3H3/t13-,15-,17?,19+,20+/m0/s1
InChIKeyHJKQFAIAZHHRKW-GLTRZDKYSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl (4S,5R,9R,13R)-16-hydroxy-5,9-dimethyl-10,14-dioxotricyclo[11.2.1.04,9]hexadec-1(15)-ene-5-carboxylate (CHEBI:181055) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
methyl (4S,5R,9R,13R)-16-hydroxy-5,9-dimethyl-10,14-dioxotricyclo[11.2.1.04,9]hexadec-1(15)-ene-5-carboxylate
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