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CHEBI:188556 - dictyol J

ChEBI IDCHEBI:188556
ChEBI Namedictyol J
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H33ClO2
Net Charge0
Average Mass340.935
Monoisotopic Mass340.21691
SMILES[H][C@@]1([C@H](C)CC[C@H](O)C(C)(C)Cl)CCC(=C)[C@]2([H])CC=C(C)[C@@]2([H])[C@@H]1O
InChIInChI=1S/C20H33ClO2/c1-12-6-10-16(13(2)8-11-17(22)20(4,5)21)19(23)18-14(3)7-9-15(12)18/h7,13,15-19,22-23H,1,6,8-11H2,2-5H3/t13-,15+,16+,17+,18-,19-/m1/s1
InChIKeyPEOMURHAYCFSHU-OPIBAUODSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
dictyol J (CHEBI:188556) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(3aS,4R,5S,8aR)-5-[(2R,5S)-6-chloro-5-hydroxy-6-methylheptan-2-yl]-3-methyl-8-methylidene-3a,4,5,6,7,8a-hexahydro-1H-azulen-4-ol
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