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CHEBI:69969 - 8alpha-hydroxylabda-13(16),14-dien-19-yl-cis-4-hydroxycinnamate

ChEBI IDCHEBI:69969
ChEBI Name8alpha-hydroxylabda-13(16),14-dien-19-yl-cis-4-hydroxycinnamate
Stars
DefinitionA natural product found in Metasequoia glyptostroboides.
Last Modified22 September 2014
DownloadsMolfile
FormulaC29H40O4
Net Charge0
Average Mass452.635
Monoisotopic Mass452.29266
SMILES[H][C@@]12CC[C@@](C)(O)[C@H](CCC(=C)C=C)[C@@]1(C)CCC[C@]2(C)COC(=O)/C=C\c1ccc(O)cc1
InChIInChI=1S/C29H40O4/c1-6-21(2)8-14-25-28(4)18-7-17-27(3,24(28)16-19-29(25,5)32)20-33-26(31)15-11-22-9-12-23(30)13-10-22/h6,9-13,15,24-25,30,32H,1-2,7-8,14,16-20H2,3-5H3/b15-11-/t24-,25+,27+,28-,29+/m0/s1
InChIKeyLXORINFASUBZBQ-DEYDKXAOSA-N
Species of MetaboliteComponentSourceComments
Metasequoia glyptostroboides (ncbitaxon:3371)
stem (BTO:0001300) PubMed (21226514) 95% ethanolic extract of air-dried, powdered stems and leaves
leaf (BTO:0000713) PubMed (21226514) 95% ethanolic extract of air-dried, powdered stems and leaves
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
8alpha-hydroxylabda-13(16),14-dien-19-yl-cis-4-hydroxycinnamate (CHEBI:69969) has role metabolite (CHEBI:25212)
8alpha-hydroxylabda-13(16),14-dien-19-yl-cis-4-hydroxycinnamate (CHEBI:69969) is a diterpenoid (CHEBI:23849)
Citations