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CHEBI:211952 - 11,12,13-Trinor-1,3,5,8-eudesmanetetrol

ChEBI IDCHEBI:211952
ChEBI Name11,12,13-Trinor-1,3,5,8-eudesmanetetrol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22O4
Net Charge0
Average Mass230.304
Monoisotopic Mass230.15181
SMILESC[C@@H]1[C@@H](O)C[C@@H](O)[C@]2(C)C[C@H](O)CC[C@@]12O
InChIInChI=1S/C12H22O4/c1-7-9(14)5-10(15)11(2)6-8(13)3-4-12(7,11)16/h7-10,13-16H,3-6H2,1-2H3/t7-,8-,9+,10-,11+,12-/m1/s1
InChIKeyVPJHVQMOXPUFGS-XZPZHEHLSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1016/j.phytol.2012.11.009)
ChEBI Ontology
Outgoing Relation(s)
11,12,13-Trinor-1,3,5,8-eudesmanetetrol (CHEBI:211952) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
(1R,3S,4R,4aR,7R,8aS)-4,8a-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-1,3,4a,7-tetrol