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CHEBI:169927 - (1R,3R,6S,7E,10S,12R)-3,10,12-trimethyl-9,13,15-trioxo-16-oxatricyclo[12.2.1.01,6]heptadeca-4,7,14(17)-trien-17-olate

ChEBI IDCHEBI:169927
ChEBI Name(1R,3R,6S,7E,10S,12R)-3,10,12-trimethyl-9,13,15-trioxo-16-oxatricyclo[12.2.1.01,6]heptadeca-4,7,14(17)-trien-17-olate
Stars
ASCII Name(1R,3R,6S,7E,10S,12R)-3,10,12-trimethyl-9,13,15-trioxo-16-oxatricyclo[12.2.1.0(1,6)]heptadeca-4,7,14(17)-trien-17-olate
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC19H21O5
Net Charge-1
Average Mass329.372
Monoisotopic Mass329.13945
SMILESC[C@@H]1C[C@H](C)C(=O)/C=C/[C@@H]2C=C[C@H](C)C[C@@]23OC(=O)C(=C3[O-])C1=O
InChIInChI=1S/C19H22O5/c1-10-4-5-13-6-7-14(20)11(2)8-12(3)16(21)15-17(22)19(13,9-10)24-18(15)23/h4-7,10-13,22H,8-9H2,1-3H3/p-1/b7-6+/t10-,11-,12+,13-,19+/m0/s1
InChIKeyOWDPBNOVKXSRIH-RSAQLFCCSA-M
ChEBI Ontology
Outgoing Relation(s)
(1R,3R,6S,7E,10S,12R)-3,10,12-trimethyl-9,13,15-trioxo-16-oxatricyclo[12.2.1.01,6]heptadeca-4,7,14(17)-trien-17-olate (CHEBI:169927) is a polyketide (CHEBI:26188)
UniProt Name  Source
(1R,3R,6S,7E,10S,12R)-17-hydroxy-3,10,12-trimethyl-16-oxatricyclo[12.2.1.01,6]heptadeca-4,7,14(17)-triene-9,13,15-trioneUniProt
Citations