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CHEBI:211729 - Tiancilactone H

ChEBI IDCHEBI:211729
ChEBI NameTiancilactone H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H34O4
Net Charge0
Average Mass362.510
Monoisotopic Mass362.24571
SMILESCC1=C[C@H]2O[C@@H](CC(=O)O)[C@@H]1[C@@]1(C)CC[C@H]3C(C)(C)[C@@H](O)CC[C@]3(C)[C@@H]21
InChIInChI=1S/C22H34O4/c1-12-10-14-19-21(4)9-7-16(23)20(2,3)15(21)6-8-22(19,5)18(12)13(26-14)11-17(24)25/h10,13-16,18-19,23H,6-9,11H2,1-5H3,(H,24,25)/t13-,14+,15-,16-,18+,19+,21-,22+/m0/s1
InChIKeyVPYDKRNAPAGWFD-SMMGSXOKSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies CB03234 (ncbitaxon:1703937) - PubMed (29806086)
ChEBI Ontology
Outgoing Relation(s)
Tiancilactone H (CHEBI:211729) is a organic heterotricyclic compound (CHEBI:26979)
Tiancilactone H (CHEBI:211729) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
2-[(1R,2R,3S,6S,8R,11R,12S,13S)-6-hydroxy-3,7,7,11,16-pentamethyl-14-oxatetracyclo[10.2.2.02,11.03,8]hexadec-15-en-13-yl]acetic acid