CHEBI:69971 - 12S,13S-dihydroxylabda-8(17),14-dien-19-oic acid

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ChEBI Name 12S,13S-dihydroxylabda-8(17),14-dien-19-oic acid
ChEBI ID CHEBI:69971
Definition A natural product found in Metasequoia glyptostroboides.
Stars This entity has been manually annotated by a third party.
Supplier Information ZINC000230540928
Download Molfile XML SDF
Formula C20H32O4
Net Charge 0
Average Mass 336.46570
Monoisotopic Mass 336.23006
InChI InChI=1S/C20H32O4/c1-6-20(5,24)16(21)12-14-13(2)8-9-15-18(14,3)10-7-11-19(15,4)17(22)23/h6,14-16,21,24H,1-2,7-12H2,3-5H3,(H,22,23)/t14-,15+,16-,18+,19-,20-/m0/s1
InChIKey GGPPLWSUIOWFBI-ZYLYKIMZSA-N
SMILES [H][C@@]12CCC(=C)[C@H](C[C@H](O)[C@@](C)(O)C=C)[C@@]1(C)CCC[C@]2(C)C(O)=O
Metabolite of Species Details
Metasequoia glyptostroboides (NCBI:txid3371) Found in stem (BTO:0001300). 95% ethanolic extract of air-dried, powdered stems and leaves See: PubMed
Metasequoia glyptostroboides (NCBI:txid3371) Found in leaf (BTO:0000713). 95% ethanolic extract of air-dried, powdered stems and leaves See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 12S,13S-dihydroxylabda-8(17),14-dien-19-oic acid (CHEBI:69971) has role metabolite (CHEBI:25212)
12S,13S-dihydroxylabda-8(17),14-dien-19-oic acid (CHEBI:69971) is a diterpenoid (CHEBI:23849)
Citation Waiting for Citations Type Source
21226514 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:tertiary alcohol(CHEBI:26878); ISA:secondary alcohol(CHEBI:35681); ISA:polyol(CHEBI:26191); ISA:monocarboxylic acid(CHEBI:25384); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);