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CHEBI:180976 - 18-Deoxy-portulide

ChEBI IDCHEBI:180976
ChEBI Name18-Deoxy-portulide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O4
Net Charge0
Average Mass334.456
Monoisotopic Mass334.21441
SMILES[H][C@]12CCC=C3C(=O)OC[C@]31CC[C@@H](C)[C@]2(C)CC/C(=C/CO)CO
InChIInChI=1S/C20H30O4/c1-14-6-10-20-13-24-18(23)16(20)4-3-5-17(20)19(14,2)9-7-15(12-22)8-11-21/h4,8,14,17,21-22H,3,5-7,9-13H2,1-2H3/b15-8-/t14-,17-,19+,20-/m1/s1
InChIKeyBYASTQVSNAVAKL-VRKDWOBOSA-N
ChEBI Ontology
Outgoing Relation(s)
18-Deoxy-portulide (CHEBI:180976) is a diterpene lactone (CHEBI:49193)
IUPAC Name 
(6aR,7S,8R,10aS)-7-[(Z)-5-hydroxy-3-(hydroxymethyl)pent-3-enyl]-7,8-dimethyl-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzouran-3-one
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