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CHEBI:197690 - Punctaporonin H

ChEBI IDCHEBI:197690
ChEBI NamePunctaporonin H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H26O5
Net Charge0
Average Mass310.390
Monoisotopic Mass310.17802
SMILESCC(=O)O[C@H]1C[C@](C)(O)/C=C\C=C(\CO)[C@H]2CC(C)(C)[C@]12O
InChIInChI=1S/C17H26O5/c1-11(19)22-14-9-16(4,20)7-5-6-12(10-18)13-8-15(2,3)17(13,14)21/h5-7,13-14,18,20-21H,8-10H2,1-4H3/b7-5-,12-6-/t13-,14+,16-,17-/m1/s1
InChIKeyKVKXBJRFFOSVQZ-IIBQJXEOSA-N
Species of MetaboliteComponentSourceComments
Ascotricha sinuosa (ncbitaxon:1217297) - PubMed (24983636)
ChEBI Ontology
Outgoing Relation(s)
Punctaporonin H (CHEBI:197690) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
[(1S,2S,4S,5Z,7E,9R)-1,4-dihydroxy-8-(hydroxymethyl)-4,11,11-trimethyl-2-bicyclo[7.2.0]undeca-5,7-dienyl] acetate
Manual XrefsDatabases
34981961ChemSpider